data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 HIS 0 3 CYS 0 4 LYS 0 5 LEU 0 6 HIS 0 7 HIS 0 8 SER 0 9 PHE 0 10 ILE 0 11 ILE 0 12 THR 0 13 VAL 0 14 LEU 0 15 ILE 0 16 SER 0 17 ILE 0 18 TYR 0 19 LEU 0 20 PHE 0 21 ASP 0 22 CYS 0 23 LEU 0 24 HIS 0 25 THR 0 26 GLN 0 27 THR 0 28 ASN 0 29 LEU 0 30 THR 0 31 ASN 0 32 ASN 0 33 PHE 0 34 THR 0 35 LEU 0 36 LEU 0 37 SER 0 38 SER 0 39 CYS 0 40 ARG 0 41 LYS 0 42 CYS 0 43 SER 0 44 THR 0 45 CYS 0 46 ASN 0 47 THR 0 48 ASN 0 49 MET 0 50 HIS 0 51 CYS 0 52 ASN 0 53 TYR 0 54 THR 0 55 GLN 0 56 TRP 0 57 ILE 0 58 SER 0 59 ILE 0 60 SER 0 61 GLY 0 62 LEU 0 63 PRO 0 64 MET 0 65 GLN 0 66 SER 0 67 PHE 0 68 LEU 0 69 GLN 0 70 THR 0 71 TYR 0 72 TRP 0 73 LEU 0 74 LYS 0 75 THR 0 76 VAL 0 77 GLU 0 78 THR 0 79 LYS 0 80 SER 0 81 ASP 0 82 CYS 0 83 LEU 0 84 ILE 0 85 VAL 0 86 CYS 0 87 ARG 0 88 PHE 0 89 HIS 0 90 PRO 0 91 GLN 0 92 CYS 0 93 LYS 0 94 LEU 0 95 TYR 0 96 THR 0 97 HIS 0 98 LYS 0 99 ALA 0 100 ILE 0 101 LYS 0 102 GLN 0 103 GLU 0 104 PHE 0 105 CYS 0 106 LYS 0 107 LEU 0 108 TYR 0 109 SER 0 110 GLY 0 111 LEU 0 112 MET 0 113 GLU 0 114 ASN 0 115 THR 0 116 THR 0 117 ILE 0 118 ASP 0 119 THR 0 120 ASN 0 121 SER 0 122 THR 0 123 ASP 0 124 HIS 0 125 TYR 0 126 VAL 0 127 THR 0 128 GLY 0 129 GLY 0 130 ARG 0 131 VAL 0 132 CYS 0 133 CYS 0 134 CYS 0 135 LYS 0 136 PHE 0 137 LYS 0 138 SER 0 139 LEU 0 140 PHE 0 141 VAL 0 142 TYR 0 143 TYR 0 144 GLY 0 145 ASP 0 146 LYS 0 147 ILE 0 148 LEU 0 149 ARG 0 150 LYS 0 151 PHE 0 152 SER 0 153 ASN 0 154 ILE 0 155 ILE 0 156 ASN # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 0 1 . -37.511 -29.678 23.752 1.00 38.44 1 A 1 ATOM 2 C CA . MET A 0 1 . -36.350 -29.963 22.872 1.00 38.44 1 A 1 ATOM 3 C C . MET A 0 1 . -36.162 -28.955 21.715 1.00 38.44 1 A 1 ATOM 4 C CB . MET A 0 1 . -36.431 -31.422 22.381 1.00 38.44 1 A 1 ATOM 5 O O . MET A 0 1 . -35.183 -29.081 20.997 1.00 38.44 1 A 1 ATOM 6 C CG . MET A 0 1 . -35.085 -32.153 22.410 1.00 38.44 1 A 1 ATOM 7 S SD . MET A 0 1 . -35.309 -33.950 22.433 1.00 38.44 1 A 1 ATOM 8 C CE . MET A 0 1 . -33.996 -34.496 21.309 1.00 38.44 1 A 1 ATOM 9 N N . HIS A 0 2 . -37.005 -27.915 21.561 1.00 41.75 2 A 1 ATOM 10 C CA . HIS A 0 2 . -36.946 -26.971 20.422 1.00 41.75 2 A 1 ATOM 11 C C . HIS A 0 2 . -35.929 -25.811 20.527 1.00 41.75 2 A 1 ATOM 12 C CB . HIS A 0 2 . -38.365 -26.425 20.154 1.00 41.75 2 A 1 ATOM 13 O O . HIS A 0 2 . -35.469 -25.319 19.503 1.00 41.75 2 A 1 ATOM 14 C CG . HIS A 0 2 . -39.186 -27.316 19.257 1.00 41.75 2 A 1 ATOM 15 C CD2 . HIS A 0 2 . -38.806 -27.760 18.018 1.00 41.75 2 A 1 ATOM 16 N ND1 . HIS A 0 2 . -40.482 -27.750 19.459 1.00 41.75 2 A 1 ATOM 17 C CE1 . HIS A 0 2 . -40.856 -28.453 18.374 1.00 41.75 2 A 1 ATOM 18 N NE2 . HIS A 0 2 . -39.856 -28.501 17.486 1.00 41.75 2 A 1 ATOM 19 N N . CYS A 0 3 . -35.508 -25.389 21.726 1.00 46.83 3 A 1 ATOM 20 C CA . CYS A 0 3 . -34.662 -24.188 21.864 1.00 46.83 3 A 1 ATOM 21 C C . CYS A 0 3 . -33.191 -24.403 21.421 1.00 46.83 3 A 1 ATOM 22 C CB . CYS A 0 3 . -34.798 -23.671 23.307 1.00 46.83 3 A 1 ATOM 23 O O . CYS A 0 3 . -32.543 -23.492 20.910 1.00 46.83 3 A 1 ATOM 24 S SG . CYS A 0 3 . -34.556 -21.877 23.315 1.00 46.83 3 A 1 ATOM 25 N N . LYS A 0 4 . -32.666 -25.636 21.537 1.00 47.22 4 A 1 ATOM 26 C CA . LYS A 0 4 . -31.286 -25.971 21.124 1.00 47.22 4 A 1 ATOM 27 C C . LYS A 0 4 . -31.100 -25.990 19.601 1.00 47.22 4 A 1 ATOM 28 C CB . LYS A 0 4 . -30.835 -27.311 21.739 1.00 47.22 4 A 1 ATOM 29 O O . LYS A 0 4 . -30.029 -25.627 19.123 1.00 47.22 4 A 1 ATOM 30 C CG . LYS A 0 4 . -30.542 -27.216 23.247 1.00 47.22 4 A 1 ATOM 31 C CD . LYS A 0 4 . -29.976 -28.539 23.797 1.00 47.22 4 A 1 ATOM 32 C CE . LYS A 0 4 . -29.656 -28.416 25.296 1.00 47.22 4 A 1 ATOM 33 N NZ . LYS A 0 4 . -29.126 -29.683 25.872 1.00 47.22 4 A 1 ATOM 34 N N . LEU A 0 5 . -32.129 -26.391 18.847 1.00 48.42 5 A 1 ATOM 35 C CA . LEU A 0 5 . -32.057 -26.503 17.386 1.00 48.42 5 A 1 ATOM 36 C C . LEU A 0 5 . -31.980 -25.116 16.727 1.00 48.42 5 A 1 ATOM 37 C CB . LEU A 0 5 . -33.269 -27.309 16.876 1.00 48.42 5 A 1 ATOM 38 O O . LEU A 0 5 . -31.165 -24.898 15.836 1.00 48.42 5 A 1 ATOM 39 C CG . LEU A 0 5 . -32.937 -28.134 15.616 1.00 48.42 5 A 1 ATOM 40 C CD1 . LEU A 0 5 . -32.291 -29.468 16.006 1.00 48.42 5 A 1 ATOM 41 C CD2 . LEU A 0 5 . -34.203 -28.432 14.818 1.00 48.42 5 A 1 ATOM 42 N N . HIS A 0 6 . -32.761 -24.159 17.238 1.00 50.53 6 A 1 ATOM 43 C CA . HIS A 0 6 . -32.817 -22.795 16.708 1.00 50.53 6 A 1 ATOM 44 C C . HIS A 0 6 . -31.495 -22.039 16.910 1.00 50.53 6 A 1 ATOM 45 C CB . HIS A 0 6 . -33.998 -22.062 17.363 1.00 50.53 6 A 1 ATOM 46 O O . HIS A 0 6 . -31.010 -21.375 15.999 1.00 50.53 6 A 1 ATOM 47 C CG . HIS A 0 6 . -34.692 -21.130 16.408 1.00 50.53 6 A 1 ATOM 48 C CD2 . HIS A 0 6 . -35.804 -21.426 15.667 1.00 50.53 6 A 1 ATOM 49 N ND1 . HIS A 0 6 . -34.322 -19.843 16.086 1.00 50.53 6 A 1 ATOM 50 C CE1 . HIS A 0 6 . -35.198 -19.374 15.180 1.00 50.53 6 A 1 ATOM 51 N NE2 . HIS A 0 6 . -36.115 -20.308 14.897 1.00 50.53 6 A 1 ATOM 52 N N . HIS A 0 7 . -30.862 -22.196 18.079 1.00 56.71 7 A 1 ATOM 53 C CA . HIS A 0 7 . -29.532 -21.632 18.333 1.00 56.71 7 A 1 ATOM 54 C C . HIS A 0 7 . -28.458 -22.256 17.437 1.00 56.71 7 A 1 ATOM 55 C CB . HIS A 0 7 . -29.164 -21.803 19.813 1.00 56.71 7 A 1 ATOM 56 O O . HIS A 0 7 . -27.618 -21.534 16.909 1.00 56.71 7 A 1 ATOM 57 C CG . HIS A 0 7 . -29.599 -20.637 20.658 1.00 56.71 7 A 1 ATOM 58 C CD2 . HIS A 0 7 . -28.795 -19.896 21.482 1.00 56.71 7 A 1 ATOM 59 N ND1 . HIS A 0 7 . -30.854 -20.071 20.703 1.00 56.71 7 A 1 ATOM 60 C CE1 . HIS A 0 7 . -30.805 -19.016 21.533 1.00 56.71 7 A 1 ATOM 61 N NE2 . HIS A 0 7 . -29.572 -18.881 22.040 1.00 56.71 7 A 1 ATOM 62 N N . SER A 0 8 . -28.495 -23.577 17.223 1.00 66.16 8 A 1 ATOM 63 C CA . SER A 0 8 . -27.554 -24.238 16.311 1.00 66.16 8 A 1 ATOM 64 C C . SER A 0 8 . -27.697 -23.715 14.882 1.00 66.16 8 A 1 ATOM 65 C CB . SER A 0 8 . -27.754 -25.753 16.332 1.00 66.16 8 A 1 ATOM 66 O O . SER A 0 8 . -26.688 -23.442 14.244 1.00 66.16 8 A 1 ATOM 67 O OG . SER A 0 8 . -26.665 -26.391 15.692 1.00 66.16 8 A 1 ATOM 68 N N . PHE A 0 9 . -28.930 -23.533 14.402 1.00 69.25 9 A 1 ATOM 69 C CA . PHE A 0 9 . -29.192 -23.041 13.050 1.00 69.25 9 A 1 ATOM 70 C C . PHE A 0 9 . -28.707 -21.598 12.854 1.00 69.25 9 A 1 ATOM 71 C CB . PHE A 0 9 . -30.687 -23.190 12.750 1.00 69.25 9 A 1 ATOM 72 O O . PHE A 0 9 . -27.986 -21.324 11.898 1.00 69.25 9 A 1 ATOM 73 C CG . PHE A 0 9 . -31.033 -22.896 11.306 1.00 69.25 9 A 1 ATOM 74 C CD1 . PHE A 0 9 . -31.586 -21.653 10.944 1.00 69.25 9 A 1 ATOM 75 C CD2 . PHE A 0 9 . -30.781 -23.865 10.317 1.00 69.25 9 A 1 ATOM 76 C CE1 . PHE A 0 9 . -31.889 -21.384 9.597 1.00 69.25 9 A 1 ATOM 77 C CE2 . PHE A 0 9 . -31.082 -23.594 8.970 1.00 69.25 9 A 1 ATOM 78 C CZ . PHE A 0 9 . -31.636 -22.353 8.611 1.00 69.25 9 A 1 ATOM 79 N N . ILE A 0 10 . -29.013 -20.694 13.796 1.00 72.88 10 A 1 ATOM 80 C CA . ILE A 0 10 . -28.553 -19.295 13.743 1.00 72.88 10 A 1 ATOM 81 C C . ILE A 0 10 . -27.020 -19.226 13.734 1.00 72.88 10 A 1 ATOM 82 C CB . ILE A 0 10 . -29.155 -18.479 14.914 1.00 72.88 10 A 1 ATOM 83 O O . ILE A 0 10 . -26.442 -18.499 12.928 1.00 72.88 10 A 1 ATOM 84 C CG1 . ILE A 0 10 . -30.687 -18.344 14.747 1.00 72.88 10 A 1 ATOM 85 C CG2 . ILE A 0 10 . -28.522 -17.074 14.996 1.00 72.88 10 A 1 ATOM 86 C CD1 . ILE A 0 10 . -31.405 -17.835 16.006 1.00 72.88 10 A 1 ATOM 87 N N . ILE A 0 11 . -26.349 -20.010 14.585 1.00 72.55 11 A 1 ATOM 88 C CA . ILE A 0 11 . -24.880 -20.045 14.635 1.00 72.55 11 A 1 ATOM 89 C C . ILE A 0 11 . -24.303 -20.538 13.302 1.00 72.55 11 A 1 ATOM 90 C CB . ILE A 0 11 . -24.401 -20.901 15.830 1.00 72.55 11 A 1 ATOM 91 O O . ILE A 0 11 . -23.361 -19.933 12.795 1.00 72.55 11 A 1 ATOM 92 C CG1 . ILE A 0 11 . -24.756 -20.212 17.168 1.00 72.55 11 A 1 ATOM 93 C CG2 . ILE A 0 11 . -22.879 -21.140 15.770 1.00 72.55 11 A 1 ATOM 94 C CD1 . ILE A 0 11 . -24.651 -21.144 18.384 1.00 72.55 11 A 1 ATOM 95 N N . THR A 0 12 . -24.864 -21.598 12.713 1.00 70.96 12 A 1 ATOM 96 C CA . THR A 0 12 . -24.401 -22.115 11.418 1.00 70.96 12 A 1 ATOM 97 C C . THR A 0 12 . -24.573 -21.084 10.306 1.00 70.96 12 A 1 ATOM 98 C CB . THR A 0 12 . -25.115 -23.424 11.054 1.00 70.96 12 A 1 ATOM 99 O O . THR A 0 12 . -23.626 -20.864 9.559 1.00 70.96 12 A 1 ATOM 100 C CG2 . THR A 0 12 . -24.604 -24.031 9.747 1.00 70.96 12 A 1 ATOM 101 O OG1 . THR A 0 12 . -24.857 -24.395 12.043 1.00 70.96 12 A 1 ATOM 102 N N . VAL A 0 13 . -25.717 -20.396 10.234 1.00 71.69 13 A 1 ATOM 103 C CA . VAL A 0 13 . -25.959 -19.344 9.230 1.00 71.69 13 A 1 ATOM 104 C C . VAL A 0 13 . -24.959 -18.195 9.376 1.00 71.69 13 A 1 ATOM 105 C CB . VAL A 0 13 . -27.414 -18.838 9.314 1.00 71.69 13 A 1 ATOM 106 O O . VAL A 0 13 . -24.374 -17.771 8.383 1.00 71.69 13 A 1 ATOM 107 C CG1 . VAL A 0 13 . -27.665 -17.612 8.428 1.00 71.69 13 A 1 ATOM 108 C CG2 . VAL A 0 13 . -28.392 -19.931 8.861 1.00 71.69 13 A 1 ATOM 109 N N . LEU A 0 14 . -24.692 -17.732 10.602 1.00 71.22 14 A 1 ATOM 110 C CA . LEU A 0 14 . -23.706 -16.672 10.851 1.00 71.22 14 A 1 ATOM 111 C C . LEU A 0 14 . -22.286 -17.089 10.444 1.00 71.22 14 A 1 ATOM 112 C CB . LEU A 0 14 . -23.739 -16.286 12.340 1.00 71.22 14 A 1 ATOM 113 O O . LEU A 0 14 . -21.552 -16.290 9.865 1.00 71.22 14 A 1 ATOM 114 C CG . LEU A 0 14 . -25.005 -15.531 12.780 1.00 71.22 14 A 1 ATOM 115 C CD1 . LEU A 0 14 . -24.990 -15.378 14.302 1.00 71.22 14 A 1 ATOM 116 C CD2 . LEU A 0 14 . -25.097 -14.138 12.156 1.00 71.22 14 A 1 ATOM 117 N N . ILE A 0 15 . -21.903 -18.343 10.711 1.00 66.98 15 A 1 ATOM 118 C CA . ILE A 0 15 . -20.616 -18.893 10.265 1.00 66.98 15 A 1 ATOM 119 C C . ILE A 0 15 . -20.569 -18.957 8.735 1.00 66.98 15 A 1 ATOM 120 C CB . ILE A 0 15 . -20.351 -20.274 10.908 1.00 66.98 15 A 1 ATOM 121 O O . ILE A 0 15 . -19.563 -18.562 8.153 1.00 66.98 15 A 1 ATOM 122 C CG1 . ILE A 0 15 . -20.130 -20.127 12.431 1.00 66.98 15 A 1 ATOM 123 C CG2 . ILE A 0 15 . -19.121 -20.959 10.278 1.00 66.98 15 A 1 ATOM 124 C CD1 . ILE A 0 15 . -20.202 -21.459 13.190 1.00 66.98 15 A 1 ATOM 125 N N . SER A 0 16 . -21.637 -19.419 8.081 1.00 67.59 16 A 1 ATOM 126 C CA . SER A 0 16 . -21.711 -19.495 6.621 1.00 67.59 16 A 1 ATOM 127 C C . SER A 0 16 . -21.584 -18.121 5.972 1.00 67.59 16 A 1 ATOM 128 C CB . SER A 0 16 . -23.016 -20.160 6.178 1.00 67.59 16 A 1 ATOM 129 O O . SER A 0 16 . -20.761 -17.977 5.076 1.00 67.59 16 A 1 ATOM 130 O OG . SER A 0 16 . -23.021 -21.523 6.557 1.00 67.59 16 A 1 ATOM 131 N N . ILE A 0 17 . -22.319 -17.110 6.450 1.00 67.15 17 A 1 ATOM 132 C CA . ILE A 0 17 . -22.215 -15.728 5.951 1.00 67.15 17 A 1 ATOM 133 C C . ILE A 0 17 . -20.772 -15.225 6.096 1.00 67.15 17 A 1 ATOM 134 C CB . ILE A 0 17 . -23.231 -14.812 6.676 1.00 67.15 17 A 1 ATOM 135 O O . ILE A 0 17 . -20.182 -14.765 5.125 1.00 67.15 17 A 1 ATOM 136 C CG1 . ILE A 0 17 . -24.681 -15.213 6.311 1.00 67.15 17 A 1 ATOM 137 C CG2 . ILE A 0 17 . -23.002 -13.332 6.312 1.00 67.15 17 A 1 ATOM 138 C CD1 . ILE A 0 17 . -25.742 -14.604 7.239 1.00 67.15 17 A 1 ATOM 139 N N . TYR A 0 18 . -20.155 -15.424 7.267 1.00 58.39 18 A 1 ATOM 140 C CA . TYR A 0 18 . -18.774 -15.001 7.507 1.00 58.39 18 A 1 ATOM 141 C C . TYR A 0 18 . -17.758 -15.719 6.604 1.00 58.39 18 A 1 ATOM 142 C CB . TYR A 0 18 . -18.436 -15.230 8.986 1.00 58.39 18 A 1 ATOM 143 O O . TYR A 0 18 . -16.805 -15.102 6.133 1.00 58.39 18 A 1 ATOM 144 C CG . TYR A 0 18 . -17.119 -14.608 9.409 1.00 58.39 18 A 1 ATOM 145 C CD1 . TYR A 0 18 . -15.947 -15.385 9.502 1.00 58.39 18 A 1 ATOM 146 C CD2 . TYR A 0 18 . -17.069 -13.227 9.667 1.00 58.39 18 A 1 ATOM 147 C CE1 . TYR A 0 18 . -14.726 -14.782 9.869 1.00 58.39 18 A 1 ATOM 148 C CE2 . TYR A 0 18 . -15.852 -12.616 10.017 1.00 58.39 18 A 1 ATOM 149 O OH . TYR A 0 18 . -13.503 -12.781 10.433 1.00 58.39 18 A 1 ATOM 150 C CZ . TYR A 0 18 . -14.678 -13.393 10.118 1.00 58.39 18 A 1 ATOM 151 N N . LEU A 0 19 . -17.945 -17.020 6.349 1.00 58.58 19 A 1 ATOM 152 C CA . LEU A 0 19 . -17.114 -17.786 5.416 1.00 58.58 19 A 1 ATOM 153 C C . LEU A 0 19 . -17.292 -17.304 3.975 1.00 58.58 19 A 1 ATOM 154 C CB . LEU A 0 19 . -17.450 -19.285 5.505 1.00 58.58 19 A 1 ATOM 155 O O . LEU A 0 19 . -16.297 -17.215 3.258 1.00 58.58 19 A 1 ATOM 156 C CG . LEU A 0 19 . -16.955 -19.997 6.774 1.00 58.58 19 A 1 ATOM 157 C CD1 . LEU A 0 19 . -17.507 -21.424 6.796 1.00 58.58 19 A 1 ATOM 158 C CD2 . LEU A 0 19 . -15.428 -20.075 6.846 1.00 58.58 19 A 1 ATOM 159 N N . PHE A 0 20 . -18.522 -16.977 3.570 1.00 59.08 20 A 1 ATOM 160 C CA . PHE A 0 20 . -18.819 -16.412 2.255 1.00 59.08 20 A 1 ATOM 161 C C . PHE A 0 20 . -18.143 -15.057 2.064 1.00 59.08 20 A 1 ATOM 162 C CB . PHE A 0 20 . -20.336 -16.310 2.033 1.00 59.08 20 A 1 ATOM 163 O O . PHE A 0 20 . -17.438 -14.892 1.073 1.00 59.08 20 A 1 ATOM 164 C CG . PHE A 0 20 . -20.909 -17.488 1.273 1.00 59.08 20 A 1 ATOM 165 C CD1 . PHE A 0 20 . -20.713 -17.573 -0.117 1.00 59.08 20 A 1 ATOM 166 C CD2 . PHE A 0 20 . -21.640 -18.493 1.933 1.00 59.08 20 A 1 ATOM 167 C CE1 . PHE A 0 20 . -21.239 -18.657 -0.840 1.00 59.08 20 A 1 ATOM 168 C CE2 . PHE A 0 20 . -22.158 -19.584 1.214 1.00 59.08 20 A 1 ATOM 169 C CZ . PHE A 0 20 . -21.958 -19.665 -0.175 1.00 59.08 20 A 1 ATOM 170 N N . ASP A 0 21 . -18.261 -14.139 3.025 1.00 57.89 21 A 1 ATOM 171 C CA . ASP A 0 21 . -17.587 -12.834 2.969 1.00 57.89 21 A 1 ATOM 172 C C . ASP A 0 21 . -16.065 -13.012 2.857 1.00 57.89 21 A 1 ATOM 173 C CB . ASP A 0 21 . -17.921 -12.023 4.233 1.00 57.89 21 A 1 ATOM 174 O O . ASP A 0 21 . -15.385 -12.367 2.055 1.00 57.89 21 A 1 ATOM 175 C CG . ASP A 0 21 . -19.380 -11.563 4.316 1.00 57.89 21 A 1 ATOM 176 O OD1 . ASP A 0 21 . -20.020 -11.436 3.250 1.00 57.89 21 A 1 ATOM 177 O OD2 . ASP A 0 21 . -19.823 -11.314 5.462 1.00 57.89 21 A 1 ATOM 178 N N . CYS A 0 22 . -15.518 -13.964 3.613 1.00 57.07 22 A 1 ATOM 179 C CA . CYS A 0 22 . -14.100 -14.287 3.570 1.00 57.07 22 A 1 ATOM 180 C C . CYS A 0 22 . -13.640 -14.848 2.228 1.00 57.07 22 A 1 ATOM 181 C CB . CYS A 0 22 . -13.790 -15.311 4.659 1.00 57.07 22 A 1 ATOM 182 O O . CYS A 0 22 . -12.603 -14.441 1.699 1.00 57.07 22 A 1 ATOM 183 S SG . CYS A 0 22 . -12.447 -14.743 5.677 1.00 57.07 22 A 1 ATOM 184 N N . LEU A 0 23 . -14.395 -15.810 1.699 1.00 53.56 23 A 1 ATOM 185 C CA . LEU A 0 23 . -14.107 -16.419 0.413 1.00 53.56 23 A 1 ATOM 186 C C . LEU A 0 23 . -14.220 -15.366 -0.686 1.00 53.56 23 A 1 ATOM 187 C CB . LEU A 0 23 . -15.051 -17.610 0.191 1.00 53.56 23 A 1 ATOM 188 O O . LEU A 0 23 . -13.319 -15.280 -1.505 1.00 53.56 23 A 1 ATOM 189 C CG . LEU A 0 23 . -14.720 -18.427 -1.071 1.00 53.56 23 A 1 ATOM 190 C CD1 . LEU A 0 23 . -13.346 -19.100 -0.978 1.00 53.56 23 A 1 ATOM 191 C CD2 . LEU A 0 23 . -15.773 -19.519 -1.255 1.00 53.56 23 A 1 ATOM 192 N N . HIS A 0 24 . -15.238 -14.507 -0.633 1.00 50.04 24 A 1 ATOM 193 C CA . HIS A 0 24 . -15.443 -13.416 -1.581 1.00 50.04 24 A 1 ATOM 194 C C . HIS A 0 24 . -14.282 -12.407 -1.574 1.00 50.04 24 A 1 ATOM 195 C CB . HIS A 0 24 . -16.778 -12.737 -1.258 1.00 50.04 24 A 1 ATOM 196 O O . HIS A 0 24 . -13.816 -11.965 -2.627 1.00 50.04 24 A 1 ATOM 197 C CG . HIS A 0 24 . -17.179 -11.739 -2.307 1.00 50.04 24 A 1 ATOM 198 C CD2 . HIS A 0 24 . -17.909 -11.996 -3.434 1.00 50.04 24 A 1 ATOM 199 N ND1 . HIS A 0 24 . -16.875 -10.398 -2.313 1.00 50.04 24 A 1 ATOM 200 C CE1 . HIS A 0 24 . -17.423 -9.858 -3.414 1.00 50.04 24 A 1 ATOM 201 N NE2 . HIS A 0 24 . -18.057 -10.794 -4.132 1.00 50.04 24 A 1 ATOM 202 N N . THR A 0 25 . -13.758 -12.069 -0.389 1.00 50.28 25 A 1 ATOM 203 C CA . THR A 0 25 . -12.598 -11.165 -0.284 1.00 50.28 25 A 1 ATOM 204 C C . THR A 0 25 . -11.336 -11.826 -0.847 1.00 50.28 25 A 1 ATOM 205 C CB . THR A 0 25 . -12.326 -10.688 1.155 1.00 50.28 25 A 1 ATOM 206 O O . THR A 0 25 . -10.549 -11.171 -1.528 1.00 50.28 25 A 1 ATOM 207 C CG2 . THR A 0 25 . -11.639 -9.320 1.144 1.00 50.28 25 A 1 ATOM 208 O OG1 . THR A 0 25 . -13.491 -10.489 1.920 1.00 50.28 25 A 1 ATOM 209 N N . GLN A 0 26 . -11.155 -13.133 -0.615 1.00 50.51 26 A 1 ATOM 210 C CA . GLN A 0 26 . -10.060 -13.901 -1.213 1.00 50.51 26 A 1 ATOM 211 C C . GLN A 0 26 . -10.208 -14.055 -2.727 1.00 50.51 26 A 1 ATOM 212 C CB . GLN A 0 26 . -9.937 -15.286 -0.560 1.00 50.51 26 A 1 ATOM 213 O O . GLN A 0 26 . -9.213 -13.928 -3.419 1.00 50.51 26 A 1 ATOM 214 C CG . GLN A 0 26 . -9.187 -15.219 0.772 1.00 50.51 26 A 1 ATOM 215 C CD . GLN A 0 26 . -9.023 -16.606 1.376 1.00 50.51 26 A 1 ATOM 216 N NE2 . GLN A 0 26 . -9.763 -16.935 2.410 1.00 50.51 26 A 1 ATOM 217 O OE1 . GLN A 0 26 . -8.239 -17.430 0.944 1.00 50.51 26 A 1 ATOM 218 N N . THR A 0 27 . -11.407 -14.284 -3.266 1.00 42.70 27 A 1 ATOM 219 C CA . THR A 0 27 . -11.603 -14.444 -4.716 1.00 42.70 27 A 1 ATOM 220 C C . THR A 0 27 . -11.378 -13.148 -5.487 1.00 42.70 27 A 1 ATOM 221 C CB . THR A 0 27 . -12.994 -14.995 -5.059 1.00 42.70 27 A 1 ATOM 222 O O . THR A 0 27 . -10.905 -13.202 -6.618 1.00 42.70 27 A 1 ATOM 223 C CG2 . THR A 0 27 . -13.148 -16.460 -4.646 1.00 42.70 27 A 1 ATOM 224 O OG1 . THR A 0 27 . -14.019 -14.272 -4.422 1.00 42.70 27 A 1 ATOM 225 N N . ASN A 0 28 . -11.671 -11.986 -4.888 1.00 46.07 28 A 1 ATOM 226 C CA . ASN A 0 28 . -11.354 -10.689 -5.502 1.00 46.07 28 A 1 ATOM 227 C C . ASN A 0 28 . -9.843 -10.413 -5.548 1.00 46.07 28 A 1 ATOM 228 C CB . ASN A 0 28 . -12.114 -9.573 -4.764 1.00 46.07 28 A 1 ATOM 229 O O . ASN A 0 28 . -9.371 -9.683 -6.416 1.00 46.07 28 A 1 ATOM 230 C CG . ASN A 0 28 . -13.553 -9.452 -5.228 1.00 46.07 28 A 1 ATOM 231 N ND2 . ASN A 0 28 . -14.448 -9.026 -4.372 1.00 46.07 28 A 1 ATOM 232 O OD1 . ASN A 0 28 . -13.905 -9.719 -6.361 1.00 46.07 28 A 1 ATOM 233 N N . LEU A 0 29 . -9.067 -11.029 -4.653 1.00 51.59 29 A 1 ATOM 234 C CA . LEU A 0 29 . -7.612 -11.068 -4.734 1.00 51.59 29 A 1 ATOM 235 C C . LEU A 0 29 . -7.217 -12.277 -5.590 1.00 51.59 29 A 1 ATOM 236 C CB . LEU A 0 29 . -7.033 -11.137 -3.308 1.00 51.59 29 A 1 ATOM 237 O O . LEU A 0 29 . -7.044 -13.376 -5.078 1.00 51.59 29 A 1 ATOM 238 C CG . LEU A 0 29 . -7.303 -9.885 -2.456 1.00 51.59 29 A 1 ATOM 239 C CD1 . LEU A 0 29 . -6.986 -10.192 -0.991 1.00 51.59 29 A 1 ATOM 240 C CD2 . LEU A 0 29 . -6.454 -8.695 -2.911 1.00 51.59 29 A 1 ATOM 241 N N . THR A 0 30 . -7.095 -12.091 -6.905 1.00 52.14 30 A 1 ATOM 242 C CA . THR A 0 30 . -6.666 -13.135 -7.860 1.00 52.14 30 A 1 ATOM 243 C C . THR A 0 30 . -5.582 -14.062 -7.289 1.00 52.14 30 A 1 ATOM 244 C CB . THR A 0 30 . -6.076 -12.486 -9.121 1.00 52.14 30 A 1 ATOM 245 O O . THR A 0 30 . -4.651 -13.567 -6.656 1.00 52.14 30 A 1 ATOM 246 C CG2 . THR A 0 30 . -7.126 -11.757 -9.955 1.00 52.14 30 A 1 ATOM 247 O OG1 . THR A 0 30 . -5.081 -11.553 -8.758 1.00 52.14 30 A 1 ATOM 248 N N . ASN A 0 31 . -5.634 -15.367 -7.594 1.00 55.39 31 A 1 ATOM 249 C CA . ASN A 0 31 . -4.726 -16.429 -7.104 1.00 55.39 31 A 1 ATOM 250 C C . ASN A 0 31 . -3.204 -16.173 -7.261 1.00 55.39 31 A 1 ATOM 251 C CB . ASN A 0 31 . -5.090 -17.744 -7.832 1.00 55.39 31 A 1 ATOM 252 O O . ASN A 0 31 . -2.399 -16.970 -6.791 1.00 55.39 31 A 1 ATOM 253 C CG . ASN A 0 31 . -6.442 -18.321 -7.455 1.00 55.39 31 A 1 ATOM 254 N ND2 . ASN A 0 31 . -7.020 -19.139 -8.305 1.00 55.39 31 A 1 ATOM 255 O OD1 . ASN A 0 31 . -7.002 -18.062 -6.409 1.00 55.39 31 A 1 ATOM 256 N N . ASN A 0 32 . -2.794 -15.081 -7.905 1.00 73.82 32 A 1 ATOM 257 C CA . ASN A 0 32 . -1.409 -14.709 -8.182 1.00 73.82 32 A 1 ATOM 258 C C . ASN A 0 32 . -0.862 -13.684 -7.173 1.00 73.82 32 A 1 ATOM 259 C CB . ASN A 0 32 . -1.324 -14.224 -9.637 1.00 73.82 32 A 1 ATOM 260 O O . ASN A 0 32 . -0.200 -12.719 -7.563 1.00 73.82 32 A 1 ATOM 261 C CG . ASN A 0 32 . -1.713 -15.292 -10.638 1.00 73.82 32 A 1 ATOM 262 N ND2 . ASN A 0 32 . -2.262 -14.900 -11.763 1.00 73.82 32 A 1 ATOM 263 O OD1 . ASN A 0 32 . -1.533 -16.480 -10.441 1.00 73.82 32 A 1 ATOM 264 N N . PHE A 0 33 . -1.153 -13.862 -5.882 1.00 82.04 33 A 1 ATOM 265 C CA . PHE A 0 33 . -0.549 -13.051 -4.826 1.00 82.04 33 A 1 ATOM 266 C C . PHE A 0 33 . 0.501 -13.839 -4.040 1.00 82.04 33 A 1 ATOM 267 C CB . PHE A 0 33 . -1.615 -12.408 -3.925 1.00 82.04 33 A 1 ATOM 268 O O . PHE A 0 33 . 0.379 -15.041 -3.814 1.00 82.04 33 A 1 ATOM 269 C CG . PHE A 0 33 . -2.323 -13.353 -2.978 1.00 82.04 33 A 1 ATOM 270 C CD1 . PHE A 0 33 . -3.573 -13.889 -3.333 1.00 82.04 33 A 1 ATOM 271 C CD2 . PHE A 0 33 . -1.739 -13.698 -1.744 1.00 82.04 33 A 1 ATOM 272 C CE1 . PHE A 0 33 . -4.228 -14.784 -2.473 1.00 82.04 33 A 1 ATOM 273 C CE2 . PHE A 0 33 . -2.391 -14.599 -0.883 1.00 82.04 33 A 1 ATOM 274 C CZ . PHE A 0 33 . -3.635 -15.145 -1.251 1.00 82.04 33 A 1 ATOM 275 N N . THR A 0 34 . 1.512 -13.129 -3.552 1.00 85.97 34 A 1 ATOM 276 C CA . THR A 0 34 . 2.519 -13.659 -2.632 1.00 85.97 34 A 1 ATOM 277 C C . THR A 0 34 . 2.229 -13.163 -1.224 1.00 85.97 34 A 1 ATOM 278 C CB . THR A 0 34 . 3.932 -13.271 -3.078 1.00 85.97 34 A 1 ATOM 279 O O . THR A 0 34 . 1.999 -11.973 -1.003 1.00 85.97 34 A 1 ATOM 280 C CG2 . THR A 0 34 . 5.021 -13.808 -2.150 1.00 85.97 34 A 1 ATOM 281 O OG1 . THR A 0 34 . 4.192 -13.823 -4.344 1.00 85.97 34 A 1 ATOM 282 N N . LEU A 0 35 . 2.261 -14.064 -0.242 1.00 85.76 35 A 1 ATOM 283 C CA . LEU A 0 35 . 2.146 -13.694 1.165 1.00 85.76 35 A 1 ATOM 284 C C . LEU A 0 35 . 3.475 -13.109 1.666 1.00 85.76 35 A 1 ATOM 285 C CB . LEU A 0 35 . 1.727 -14.928 1.982 1.00 85.76 35 A 1 ATOM 286 O O . LEU A 0 35 . 4.500 -13.782 1.637 1.00 85.76 35 A 1 ATOM 287 C CG . LEU A 0 35 . 1.335 -14.569 3.425 1.00 85.76 35 A 1 ATOM 288 C CD1 . LEU A 0 35 . -0.092 -14.029 3.491 1.00 85.76 35 A 1 ATOM 289 C CD2 . LEU A 0 35 . 1.429 -15.790 4.337 1.00 85.76 35 A 1 ATOM 290 N N . LEU A 0 36 . 3.448 -11.881 2.187 1.00 87.99 36 A 1 ATOM 291 C CA . LEU A 0 36 . 4.638 -11.206 2.725 1.00 87.99 36 A 1 ATOM 292 C C . LEU A 0 36 . 4.721 -11.257 4.253 1.00 87.99 36 A 1 ATOM 293 C CB . LEU A 0 36 . 4.638 -9.746 2.263 1.00 87.99 36 A 1 ATOM 294 O O . LEU A 0 36 . 5.769 -11.001 4.845 1.00 87.99 36 A 1 ATOM 295 C CG . LEU A 0 36 . 4.646 -9.534 0.743 1.00 87.99 36 A 1 ATOM 296 C CD1 . LEU A 0 36 . 4.602 -8.029 0.498 1.00 87.99 36 A 1 ATOM 297 C CD2 . LEU A 0 36 . 5.898 -10.114 0.086 1.00 87.99 36 A 1 ATOM 298 N N . SER A 0 37 . 3.607 -11.540 4.929 1.00 86.10 37 A 1 ATOM 299 C CA . SER A 0 37 . 3.578 -11.624 6.387 1.00 86.10 37 A 1 ATOM 300 C C . SER A 0 37 . 2.513 -12.587 6.881 1.00 86.10 37 A 1 ATOM 301 C CB . SER A 0 37 . 3.325 -10.239 6.995 1.00 86.10 37 A 1 ATOM 302 O O . SER A 0 37 . 1.441 -12.680 6.292 1.00 86.10 37 A 1 ATOM 303 O OG . SER A 0 37 . 1.974 -9.851 6.832 1.00 86.10 37 A 1 ATOM 304 N N . SER A 0 38 . 2.737 -13.180 8.052 1.00 85.45 38 A 1 ATOM 305 C CA . SER A 0 38 . 1.679 -13.883 8.772 1.00 85.45 38 A 1 ATOM 306 C C . SER A 0 38 . 0.563 -12.943 9.229 1.00 85.45 38 A 1 ATOM 307 C CB . SER A 0 38 . 2.256 -14.663 9.958 1.00 85.45 38 A 1 ATOM 308 O O . SER A 0 38 . 0.760 -11.739 9.421 1.00 85.45 38 A 1 ATOM 309 O OG . SER A 0 38 . 2.905 -13.836 10.917 1.00 85.45 38 A 1 ATOM 310 N N . CYS A 0 39 . -0.615 -13.518 9.456 1.00 85.06 39 A 1 ATOM 311 C CA . CYS A 0 39 . -1.749 -12.789 9.987 1.00 85.06 39 A 1 ATOM 312 C C . CYS A 0 39 . -1.474 -12.241 11.397 1.00 85.06 39 A 1 ATOM 313 C CB . CYS A 0 39 . -2.956 -13.721 10.000 1.00 85.06 39 A 1 ATOM 314 O O . CYS A 0 39 . -1.218 -13.005 12.335 1.00 85.06 39 A 1 ATOM 315 S SG . CYS A 0 39 . -4.385 -12.822 10.589 1.00 85.06 39 A 1 ATOM 316 N N . ARG A 0 40 . -1.574 -10.919 11.573 1.00 84.45 40 A 1 ATOM 317 C CA . ARG A 0 40 . -1.330 -10.250 12.860 1.00 84.45 40 A 1 ATOM 318 C C . ARG A 0 40 . -2.451 -9.287 13.211 1.00 84.45 40 A 1 ATOM 319 C CB . ARG A 0 40 . 0.034 -9.542 12.843 1.00 84.45 40 A 1 ATOM 320 O O . ARG A 0 40 . -3.104 -8.721 12.339 1.00 84.45 40 A 1 ATOM 321 C CG . ARG A 0 40 . 1.196 -10.545 12.784 1.00 84.45 40 A 1 ATOM 322 C CD . ARG A 0 40 . 2.542 -9.822 12.866 1.00 84.45 40 A 1 ATOM 323 N NE . ARG A 0 40 . 3.665 -10.770 12.727 1.00 84.45 40 A 1 ATOM 324 N NH1 . ARG A 0 40 . 5.247 -9.580 13.903 1.00 84.45 40 A 1 ATOM 325 N NH2 . ARG A 0 40 . 5.793 -11.538 12.995 1.00 84.45 40 A 1 ATOM 326 C CZ . ARG A 0 40 . 4.889 -10.626 13.207 1.00 84.45 40 A 1 ATOM 327 N N . LYS A 0 41 . -2.663 -9.094 14.515 1.00 83.62 41 A 1 ATOM 328 C CA . LYS A 0 41 . -3.589 -8.077 15.016 1.00 83.62 41 A 1 ATOM 329 C C . LYS A 0 41 . -3.061 -6.693 14.631 1.00 83.62 41 A 1 ATOM 330 C CB . LYS A 0 41 . -3.782 -8.232 16.534 1.00 83.62 41 A 1 ATOM 331 O O . LYS A 0 41 . -1.890 -6.403 14.868 1.00 83.62 41 A 1 ATOM 332 C CG . LYS A 0 41 . -4.913 -7.336 17.066 1.00 83.62 41 A 1 ATOM 333 C CD . LYS A 0 41 . -5.110 -7.521 18.579 1.00 83.62 41 A 1 ATOM 334 C CE . LYS A 0 41 . -6.254 -6.624 19.077 1.00 83.62 41 A 1 ATOM 335 N NZ . LYS A 0 41 . -6.443 -6.714 20.551 1.00 83.62 41 A 1 ATOM 336 N N . CYS A 0 42 . -3.924 -5.852 14.077 1.00 81.76 42 A 1 ATOM 337 C CA . CYS A 0 42 . -3.610 -4.473 13.732 1.00 81.76 42 A 1 ATOM 338 C C . CYS A 0 42 . -4.516 -3.536 14.533 1.00 81.76 42 A 1 ATOM 339 C CB . CYS A 0 42 . -3.784 -4.283 12.228 1.00 81.76 42 A 1 ATOM 340 O O . CYS A 0 42 . -5.675 -3.336 14.185 1.00 81.76 42 A 1 ATOM 341 S SG . CYS A 0 42 . -3.464 -2.584 11.710 1.00 81.76 42 A 1 ATOM 342 N N . SER A 0 43 . -3.993 -2.965 15.619 1.00 75.25 43 A 1 ATOM 343 C CA . SER A 0 43 . -4.755 -2.063 16.495 1.00 75.25 43 A 1 ATOM 344 C C . SER A 0 43 . -5.175 -0.762 15.808 1.00 75.25 43 A 1 ATOM 345 C CB . SER A 0 43 . -3.928 -1.728 17.742 1.00 75.25 43 A 1 ATOM 346 O O . SER A 0 43 . -6.207 -0.200 16.155 1.00 75.25 43 A 1 ATOM 347 O OG . SER A 0 43 . -2.603 -1.384 17.375 1.00 75.25 43 A 1 ATOM 348 N N . THR A 0 44 . -4.408 -0.297 14.821 1.00 72.76 44 A 1 ATOM 349 C CA . THR A 0 44 . -4.664 0.956 14.096 1.00 72.76 44 A 1 ATOM 350 C C . THR A 0 44 . -5.522 0.780 12.842 1.00 72.76 44 A 1 ATOM 351 C CB . THR A 0 44 . -3.341 1.641 13.728 1.00 72.76 44 A 1 ATOM 352 O O . THR A 0 44 . -5.898 1.770 12.221 1.00 72.76 44 A 1 ATOM 353 C CG2 . THR A 0 44 . -2.545 2.052 14.968 1.00 72.76 44 A 1 ATOM 354 O OG1 . THR A 0 44 . -2.514 0.766 12.987 1.00 72.76 44 A 1 ATOM 355 N N . CYS A 0 45 . -5.851 -0.457 12.452 1.00 71.84 45 A 1 ATOM 356 C CA . CYS A 0 45 . -6.594 -0.724 11.219 1.00 71.84 45 A 1 ATOM 357 C C . CYS A 0 45 . -8.099 -0.469 11.346 1.00 71.84 45 A 1 ATOM 358 C CB . CYS A 0 45 . -6.326 -2.153 10.742 1.00 71.84 45 A 1 ATOM 359 O O . CYS A 0 45 . -8.744 -0.239 10.327 1.00 71.84 45 A 1 ATOM 360 S SG . CYS A 0 45 . -4.661 -2.417 10.083 1.00 71.84 45 A 1 ATOM 361 N N . ASN A 0 46 . -8.640 -0.448 12.568 1.00 59.74 46 A 1 ATOM 362 C CA . ASN A 0 46 . -10.082 -0.365 12.829 1.00 59.74 46 A 1 ATOM 363 C C . ASN A 0 46 . -10.763 0.888 12.259 1.00 59.74 46 A 1 ATOM 364 C CB . ASN A 0 46 . -10.311 -0.448 14.352 1.00 59.74 46 A 1 ATOM 365 O O . ASN A 0 46 . -11.980 0.909 12.139 1.00 59.74 46 A 1 ATOM 366 C CG . ASN A 0 46 . -10.041 -1.828 14.921 1.00 59.74 46 A 1 ATOM 367 N ND2 . ASN A 0 46 . -10.257 -2.034 16.196 1.00 59.74 46 A 1 ATOM 368 O OD1 . ASN A 0 46 . -9.636 -2.753 14.242 1.00 59.74 46 A 1 ATOM 369 N N . THR A 0 47 . -10.003 1.929 11.915 1.00 67.51 47 A 1 ATOM 370 C CA . THR A 0 47 . -10.552 3.152 11.315 1.00 67.51 47 A 1 ATOM 371 C C . THR A 0 47 . -10.832 3.026 9.823 1.00 67.51 47 A 1 ATOM 372 C CB . THR A 0 47 . -9.600 4.333 11.532 1.00 67.51 47 A 1 ATOM 373 O O . THR A 0 47 . -11.631 3.791 9.302 1.00 67.51 47 A 1 ATOM 374 C CG2 . THR A 0 47 . -9.501 4.706 13.011 1.00 67.51 47 A 1 ATOM 375 O OG1 . THR A 0 47 . -8.291 4.008 11.099 1.00 67.51 47 A 1 ATOM 376 N N . ASN A 0 48 . -10.163 2.108 9.120 1.00 70.35 48 A 1 ATOM 377 C CA . ASN A 0 48 . -10.215 2.041 7.658 1.00 70.35 48 A 1 ATOM 378 C C . ASN A 0 48 . -10.500 0.639 7.115 1.00 70.35 48 A 1 ATOM 379 C CB . ASN A 0 48 . -8.884 2.561 7.101 1.00 70.35 48 A 1 ATOM 380 O O . ASN A 0 48 . -11.042 0.528 6.026 1.00 70.35 48 A 1 ATOM 381 C CG . ASN A 0 48 . -8.690 4.050 7.305 1.00 70.35 48 A 1 ATOM 382 N ND2 . ASN A 0 48 . -7.770 4.469 8.133 1.00 70.35 48 A 1 ATOM 383 O OD1 . ASN A 0 48 . -9.223 4.875 6.603 1.00 70.35 48 A 1 ATOM 384 N N . MET A 0 49 . -10.112 -0.416 7.834 1.00 75.61 49 A 1 ATOM 385 C CA . MET A 0 49 . -10.367 -1.802 7.444 1.00 75.61 49 A 1 ATOM 386 C C . MET A 0 49 . -11.441 -2.392 8.355 1.00 75.61 49 A 1 ATOM 387 C CB . MET A 0 49 . -9.081 -2.644 7.500 1.00 75.61 49 A 1 ATOM 388 O O . MET A 0 49 . -11.395 -2.207 9.572 1.00 75.61 49 A 1 ATOM 389 C CG . MET A 0 49 . -7.960 -2.071 6.627 1.00 75.61 49 A 1 ATOM 390 S SD . MET A 0 49 . -6.459 -3.088 6.518 1.00 75.61 49 A 1 ATOM 391 C CE . MET A 0 49 . -6.937 -4.174 5.143 1.00 75.61 49 A 1 ATOM 392 N N . HIS A 0 50 . -12.358 -3.181 7.795 1.00 77.85 50 A 1 ATOM 393 C CA . HIS A 0 50 . -13.427 -3.857 8.543 1.00 77.85 50 A 1 ATOM 394 C C . HIS A 0 50 . -12.933 -5.082 9.345 1.00 77.85 50 A 1 ATOM 395 C CB . HIS A 0 50 . -14.587 -4.180 7.589 1.00 77.85 50 A 1 ATOM 396 O O . HIS A 0 50 . -13.691 -6.003 9.648 1.00 77.85 50 A 1 ATOM 397 C CG . HIS A 0 50 . -15.236 -2.941 7.026 1.00 77.85 50 A 1 ATOM 398 C CD2 . HIS A 0 50 . -15.133 -2.464 5.746 1.00 77.85 50 A 1 ATOM 399 N ND1 . HIS A 0 50 . -16.042 -2.065 7.721 1.00 77.85 50 A 1 ATOM 400 C CE1 . HIS A 0 50 . -16.413 -1.085 6.882 1.00 77.85 50 A 1 ATOM 401 N NE2 . HIS A 0 50 . -15.877 -1.283 5.672 1.00 77.85 50 A 1 ATOM 402 N N . CYS A 0 51 . -11.648 -5.123 9.707 1.00 77.66 51 A 1 ATOM 403 C CA . CYS A 0 51 . -11.020 -6.269 10.348 1.00 77.66 51 A 1 ATOM 404 C C . CYS A 0 51 . -9.942 -5.872 11.365 1.00 77.66 51 A 1 ATOM 405 C CB . CYS A 0 51 . -10.450 -7.185 9.264 1.00 77.66 51 A 1 ATOM 406 O O . CYS A 0 51 . -9.145 -4.960 11.173 1.00 77.66 51 A 1 ATOM 407 S SG . CYS A 0 51 . -9.172 -6.393 8.269 1.00 77.66 51 A 1 ATOM 408 N N . ASN A 0 52 . -9.872 -6.653 12.445 1.00 82.36 52 A 1 ATOM 409 C CA . ASN A 0 52 . -8.868 -6.496 13.505 1.00 82.36 52 A 1 ATOM 410 C C . ASN A 0 52 . -7.541 -7.210 13.195 1.00 82.36 52 A 1 ATOM 411 C CB . ASN A 0 52 . -9.461 -7.056 14.807 1.00 82.36 52 A 1 ATOM 412 O O . ASN A 0 52 . -6.558 -7.053 13.921 1.00 82.36 52 A 1 ATOM 413 C CG . ASN A 0 52 . -10.508 -6.148 15.419 1.00 82.36 52 A 1 ATOM 414 N ND2 . ASN A 0 52 . -11.753 -6.553 15.477 1.00 82.36 52 A 1 ATOM 415 O OD1 . ASN A 0 52 . -10.209 -5.101 15.946 1.00 82.36 52 A 1 ATOM 416 N N . TYR A 0 53 . -7.536 -8.076 12.183 1.00 84.52 53 A 1 ATOM 417 C CA . TYR A 0 53 . -6.413 -8.927 11.821 1.00 84.52 53 A 1 ATOM 418 C C . TYR A 0 53 . -6.117 -8.732 10.349 1.00 84.52 53 A 1 ATOM 419 C CB . TYR A 0 53 . -6.730 -10.393 12.116 1.00 84.52 53 A 1 ATOM 420 O O . TYR A 0 53 . -7.021 -8.840 9.527 1.00 84.52 53 A 1 ATOM 421 C CG . TYR A 0 53 . -6.692 -10.758 13.582 1.00 84.52 53 A 1 ATOM 422 C CD1 . TYR A 0 53 . -5.519 -11.293 14.146 1.00 84.52 53 A 1 ATOM 423 C CD2 . TYR A 0 53 . -7.830 -10.545 14.379 1.00 84.52 53 A 1 ATOM 424 C CE1 . TYR A 0 53 . -5.487 -11.619 15.514 1.00 84.52 53 A 1 ATOM 425 C CE2 . TYR A 0 53 . -7.805 -10.870 15.748 1.00 84.52 53 A 1 ATOM 426 O OH . TYR A 0 53 . -6.592 -11.743 17.630 1.00 84.52 53 A 1 ATOM 427 C CZ . TYR A 0 53 . -6.631 -11.413 16.313 1.00 84.52 53 A 1 ATOM 428 N N . THR A 0 54 . -4.860 -8.459 10.035 1.00 86.76 54 A 1 ATOM 429 C CA . THR A 0 54 . -4.426 -8.125 8.682 1.00 86.76 54 A 1 ATOM 430 C C . THR A 0 54 . -3.128 -8.829 8.340 1.00 86.76 54 A 1 ATOM 431 C CB . THR A 0 54 . -4.227 -6.616 8.517 1.00 86.76 54 A 1 ATOM 432 O O . THR A 0 54 . -2.332 -9.152 9.229 1.00 86.76 54 A 1 ATOM 433 C CG2 . THR A 0 54 . -5.495 -5.819 8.806 1.00 86.76 54 A 1 ATOM 434 O OG1 . THR A 0 54 . -3.201 -6.165 9.383 1.00 86.76 54 A 1 ATOM 435 N N . GLN A 0 55 . -2.884 -8.990 7.050 1.00 88.91 55 A 1 ATOM 436 C CA . GLN A 0 55 . -1.624 -9.478 6.510 1.00 88.91 55 A 1 ATOM 437 C C . GLN A 0 55 . -1.207 -8.631 5.310 1.00 88.91 55 A 1 ATOM 438 C CB . GLN A 0 55 . -1.741 -10.972 6.181 1.00 88.91 55 A 1 ATOM 439 O O . GLN A 0 55 . -2.032 -7.958 4.695 1.00 88.91 55 A 1 ATOM 440 C CG . GLN A 0 55 . -2.795 -11.298 5.109 1.00 88.91 55 A 1 ATOM 441 C CD . GLN A 0 55 . -3.017 -12.797 4.947 1.00 88.91 55 A 1 ATOM 442 N NE2 . GLN A 0 55 . -3.699 -13.213 3.903 1.00 88.91 55 A 1 ATOM 443 O OE1 . GLN A 0 55 . -2.622 -13.610 5.771 1.00 88.91 55 A 1 ATOM 444 N N . TRP A 0 56 . 0.085 -8.637 5.011 1.00 91.68 56 A 1 ATOM 445 C CA . TRP A 0 56 . 0.645 -8.029 3.816 1.00 91.68 56 A 1 ATOM 446 C C . TRP A 0 56 . 0.759 -9.070 2.712 1.00 91.68 56 A 1 ATOM 447 C CB . TRP A 0 56 . 1.999 -7.404 4.142 1.00 91.68 56 A 1 ATOM 448 O O . TRP A 0 56 . 1.230 -10.187 2.950 1.00 91.68 56 A 1 ATOM 449 C CG . TRP A 0 56 . 1.916 -6.207 5.033 1.00 91.68 56 A 1 ATOM 450 C CD1 . TRP A 0 56 . 1.986 -6.211 6.381 1.00 91.68 56 A 1 ATOM 451 C CD2 . TRP A 0 56 . 1.754 -4.816 4.637 1.00 91.68 56 A 1 ATOM 452 C CE2 . TRP A 0 56 . 1.774 -4.008 5.814 1.00 91.68 56 A 1 ATOM 453 C CE3 . TRP A 0 56 . 1.622 -4.161 3.395 1.00 91.68 56 A 1 ATOM 454 N NE1 . TRP A 0 56 . 1.917 -4.913 6.852 1.00 91.68 56 A 1 ATOM 455 C CH2 . TRP A 0 56 . 1.505 -1.991 4.502 1.00 91.68 56 A 1 ATOM 456 C CZ2 . TRP A 0 56 . 1.674 -2.607 5.751 1.00 91.68 56 A 1 ATOM 457 C CZ3 . TRP A 0 56 . 1.488 -2.763 3.329 1.00 91.68 56 A 1 ATOM 458 N N . ILE A 0 57 . 0.355 -8.674 1.514 1.00 90.79 57 A 1 ATOM 459 C CA . ILE A 0 57 . 0.506 -9.449 0.285 1.00 90.79 57 A 1 ATOM 460 C C . ILE A 0 57 . 1.187 -8.594 -0.782 1.00 90.79 57 A 1 ATOM 461 C CB . ILE A 0 57 . -0.853 -9.989 -0.213 1.00 90.79 57 A 1 ATOM 462 O O . ILE A 0 57 . 1.196 -7.365 -0.664 1.00 90.79 57 A 1 ATOM 463 C CG1 . ILE A 0 57 . -1.828 -8.848 -0.583 1.00 90.79 57 A 1 ATOM 464 C CG2 . ILE A 0 57 . -1.465 -10.941 0.830 1.00 90.79 57 A 1 ATOM 465 C CD1 . ILE A 0 57 . -3.041 -9.337 -1.373 1.00 90.79 57 A 1 ATOM 466 N N . SER A 0 58 . 1.704 -9.230 -1.828 1.00 91.22 58 A 1 ATOM 467 C CA . SER A 0 58 . 2.081 -8.572 -3.078 1.00 91.22 58 A 1 ATOM 468 C C . SER A 0 58 . 1.446 -9.233 -4.293 1.00 91.22 58 A 1 ATOM 469 C CB . SER A 0 58 . 3.594 -8.485 -3.268 1.00 91.22 58 A 1 ATOM 470 O O . SER A 0 58 . 1.211 -10.436 -4.297 1.00 91.22 58 A 1 ATOM 471 O OG . SER A 0 58 . 4.213 -9.750 -3.161 1.00 91.22 58 A 1 ATOM 472 N N . ILE A 0 59 . 1.180 -8.431 -5.320 1.00 89.97 59 A 1 ATOM 473 C CA . ILE A 0 59 . 0.607 -8.826 -6.607 1.00 89.97 59 A 1 ATOM 474 C C . ILE A 0 59 . 1.455 -8.179 -7.707 1.00 89.97 59 A 1 ATOM 475 C CB . ILE A 0 59 . -0.880 -8.393 -6.703 1.00 89.97 59 A 1 ATOM 476 O O . ILE A 0 59 . 1.876 -7.027 -7.571 1.00 89.97 59 A 1 ATOM 477 C CG1 . ILE A 0 59 . -1.700 -8.938 -5.510 1.00 89.97 59 A 1 ATOM 478 C CG2 . ILE A 0 59 . -1.495 -8.883 -8.026 1.00 89.97 59 A 1 ATOM 479 C CD1 . ILE A 0 59 . -3.174 -8.517 -5.487 1.00 89.97 59 A 1 ATOM 480 N N . SER A 0 60 . 1.720 -8.903 -8.792 1.00 89.09 60 A 1 ATOM 481 C CA . SER A 0 60 . 2.340 -8.326 -9.989 1.00 89.09 60 A 1 ATOM 482 C C . SER A 0 60 . 1.369 -7.384 -10.699 1.00 89.09 60 A 1 ATOM 483 C CB . SER A 0 60 . 2.773 -9.429 -10.954 1.00 89.09 60 A 1 ATOM 484 O O . SER A 0 60 . 0.215 -7.733 -10.916 1.00 89.09 60 A 1 ATOM 485 O OG . SER A 0 60 . 3.793 -10.207 -10.357 1.00 89.09 60 A 1 ATOM 486 N N . GLY A 0 61 . 1.846 -6.206 -11.083 1.00 90.16 61 A 1 ATOM 487 C CA . GLY A 0 61 . 1.048 -5.168 -11.727 1.00 90.16 61 A 1 ATOM 488 C C . GLY A 0 61 . 0.977 -3.876 -10.922 1.00 90.16 61 A 1 ATOM 489 O O . GLY A 0 61 . 1.621 -3.734 -9.875 1.00 90.16 61 A 1 ATOM 490 N N . LEU A 0 62 . 0.181 -2.935 -11.426 1.00 90.72 62 A 1 ATOM 491 C CA . LEU A 0 62 . -0.084 -1.631 -10.811 1.00 90.72 62 A 1 ATOM 492 C C . LEU A 0 62 . -1.577 -1.431 -10.548 1.00 90.72 62 A 1 ATOM 493 C CB . LEU A 0 62 . 0.399 -0.493 -11.731 1.00 90.72 62 A 1 ATOM 494 O O . LEU A 0 62 . -2.396 -1.872 -11.346 1.00 90.72 62 A 1 ATOM 495 C CG . LEU A 0 62 . 1.898 -0.211 -11.651 1.00 90.72 62 A 1 ATOM 496 C CD1 . LEU A 0 62 . 2.311 0.776 -12.739 1.00 90.72 62 A 1 ATOM 497 C CD2 . LEU A 0 62 . 2.307 0.365 -10.290 1.00 90.72 62 A 1 ATOM 498 N N . PRO A 0 63 . -1.955 -0.688 -9.497 1.00 90.21 63 A 1 ATOM 499 C CA . PRO A 0 63 . -3.280 -0.103 -9.398 1.00 90.21 63 A 1 ATOM 500 C C . PRO A 0 63 . -3.640 0.699 -10.649 1.00 90.21 63 A 1 ATOM 501 C CB . PRO A 0 63 . -3.220 0.826 -8.185 1.00 90.21 63 A 1 ATOM 502 O O . PRO A 0 63 . -2.780 1.364 -11.231 1.00 90.21 63 A 1 ATOM 503 C CG . PRO A 0 63 . -2.102 0.259 -7.325 1.00 90.21 63 A 1 ATOM 504 C CD . PRO A 0 63 . -1.142 -0.303 -8.363 1.00 90.21 63 A 1 ATOM 505 N N . MET A 0 64 . -4.927 0.718 -10.996 1.00 90.41 64 A 1 ATOM 506 C CA . MET A 0 64 . -5.448 1.639 -12.007 1.00 90.41 64 A 1 ATOM 507 C C . MET A 0 64 . -5.036 3.090 -11.717 1.00 90.41 64 A 1 ATOM 508 C CB . MET A 0 64 . -6.977 1.565 -12.083 1.00 90.41 64 A 1 ATOM 509 O O . MET A 0 64 . -4.961 3.527 -10.566 1.00 90.41 64 A 1 ATOM 510 C CG . MET A 0 64 . -7.477 0.260 -12.704 1.00 90.41 64 A 1 ATOM 511 S SD . MET A 0 64 . -9.275 0.228 -12.936 1.00 90.41 64 A 1 ATOM 512 C CE . MET A 0 64 . -9.453 1.320 -14.372 1.00 90.41 64 A 1 ATOM 513 N N . GLN A 0 65 . -4.834 3.866 -12.782 1.00 91.08 65 A 1 ATOM 514 C CA . GLN A 0 65 . -4.322 5.235 -12.703 1.00 91.08 65 A 1 ATOM 515 C C . GLN A 0 65 . -5.137 6.154 -11.775 1.00 91.08 65 A 1 ATOM 516 C CB . GLN A 0 65 . -4.263 5.794 -14.134 1.00 91.08 65 A 1 ATOM 517 O O . GLN A 0 65 . -4.556 6.977 -11.068 1.00 91.08 65 A 1 ATOM 518 C CG . GLN A 0 65 . -3.600 7.175 -14.223 1.00 91.08 65 A 1 ATOM 519 C CD . GLN A 0 65 . -2.153 7.191 -13.742 1.00 91.08 65 A 1 ATOM 520 N NE2 . GLN A 0 65 . -1.675 8.322 -13.275 1.00 91.08 65 A 1 ATOM 521 O OE1 . GLN A 0 65 . -1.420 6.219 -13.774 1.00 91.08 65 A 1 ATOM 522 N N . SER A 0 66 . -6.463 5.991 -11.729 1.00 92.73 66 A 1 ATOM 523 C CA . SER A 0 66 . -7.343 6.744 -10.826 1.00 92.73 66 A 1 ATOM 524 C C . SER A 0 66 . -6.987 6.511 -9.357 1.00 92.73 66 A 1 ATOM 525 C CB . SER A 0 66 . -8.807 6.363 -11.080 1.00 92.73 66 A 1 ATOM 526 O O . SER A 0 66 . -6.804 7.467 -8.607 1.00 92.73 66 A 1 ATOM 527 O OG . SER A 0 66 . -8.968 4.953 -11.038 1.00 92.73 66 A 1 ATOM 528 N N . PHE A 0 67 . -6.783 5.254 -8.954 1.00 92.13 67 A 1 ATOM 529 C CA . PHE A 0 67 . -6.338 4.915 -7.604 1.00 92.13 67 A 1 ATOM 530 C C . PHE A 0 67 . -4.973 5.538 -7.300 1.00 92.13 67 A 1 ATOM 531 C CB . PHE A 0 67 . -6.279 3.390 -7.446 1.00 92.13 67 A 1 ATOM 532 O O . PHE A 0 67 . -4.780 6.121 -6.228 1.00 92.13 67 A 1 ATOM 533 C CG . PHE A 0 67 . -5.875 2.951 -6.054 1.00 92.13 67 A 1 ATOM 534 C CD1 . PHE A 0 67 . -4.516 2.920 -5.682 1.00 92.13 67 A 1 ATOM 535 C CD2 . PHE A 0 67 . -6.862 2.593 -5.119 1.00 92.13 67 A 1 ATOM 536 C CE1 . PHE A 0 67 . -4.148 2.528 -4.386 1.00 92.13 67 A 1 ATOM 537 C CE2 . PHE A 0 67 . -6.491 2.182 -3.827 1.00 92.13 67 A 1 ATOM 538 C CZ . PHE A 0 67 . -5.134 2.141 -3.464 1.00 92.13 67 A 1 ATOM 539 N N . LEU A 0 68 . -4.033 5.433 -8.250 1.00 92.14 68 A 1 ATOM 540 C CA . LEU A 0 68 . -2.691 5.987 -8.089 1.00 92.14 68 A 1 ATOM 541 C C . LEU A 0 68 . -2.738 7.490 -7.821 1.00 92.14 68 A 1 ATOM 542 C CB . LEU A 0 68 . -1.813 5.707 -9.324 1.00 92.14 68 A 1 ATOM 543 O O . LEU A 0 68 . -1.981 7.956 -6.985 1.00 92.14 68 A 1 ATOM 544 C CG . LEU A 0 68 . -1.558 4.226 -9.637 1.00 92.14 68 A 1 ATOM 545 C CD1 . LEU A 0 68 . -0.699 4.098 -10.893 1.00 92.14 68 A 1 ATOM 546 C CD2 . LEU A 0 68 . -0.800 3.520 -8.518 1.00 92.14 68 A 1 ATOM 547 N N . GLN A 0 69 . -3.611 8.242 -8.487 1.00 93.50 69 A 1 ATOM 548 C CA . GLN A 0 69 . -3.711 9.693 -8.306 1.00 93.50 69 A 1 ATOM 549 C C . GLN A 0 69 . -4.447 10.080 -7.020 1.00 93.50 69 A 1 ATOM 550 C CB . GLN A 0 69 . -4.395 10.299 -9.535 1.00 93.50 69 A 1 ATOM 551 O O . GLN A 0 69 . -4.007 10.990 -6.321 1.00 93.50 69 A 1 ATOM 552 C CG . GLN A 0 69 . -3.462 10.252 -10.753 1.00 93.50 69 A 1 ATOM 553 C CD . GLN A 0 69 . -4.138 10.705 -12.040 1.00 93.50 69 A 1 ATOM 554 N NE2 . GLN A 0 69 . -3.375 11.101 -13.038 1.00 93.50 69 A 1 ATOM 555 O OE1 . GLN A 0 69 . -5.343 10.693 -12.201 1.00 93.50 69 A 1 ATOM 556 N N . THR A 0 70 . -5.536 9.388 -6.680 1.00 96.11 70 A 1 ATOM 557 C CA . THR A 0 70 . -6.369 9.736 -5.518 1.00 96.11 70 A 1 ATOM 558 C C . THR A 0 70 . -5.689 9.436 -4.184 1.00 96.11 70 A 1 ATOM 559 C CB . THR A 0 70 . -7.705 8.983 -5.594 1.00 96.11 70 A 1 ATOM 560 O O . THR A 0 70 . -5.858 10.186 -3.225 1.00 96.11 70 A 1 ATOM 561 C CG2 . THR A 0 70 . -8.671 9.325 -4.462 1.00 96.11 70 A 1 ATOM 562 O OG1 . THR A 0 70 . -8.368 9.313 -6.791 1.00 96.11 70 A 1 ATOM 563 N N . TYR A 0 71 . -4.928 8.343 -4.103 1.00 95.98 71 A 1 ATOM 564 C CA . TYR A 0 71 . -4.387 7.848 -2.834 1.00 95.98 71 A 1 ATOM 565 C C . TYR A 0 71 . -2.877 8.024 -2.685 1.00 95.98 71 A 1 ATOM 566 C CB . TYR A 0 71 . -4.811 6.390 -2.643 1.00 95.98 71 A 1 ATOM 567 O O . TYR A 0 71 . -2.309 7.515 -1.716 1.00 95.98 71 A 1 ATOM 568 C CG . TYR A 0 71 . -6.308 6.207 -2.514 1.00 95.98 71 A 1 ATOM 569 C CD1 . TYR A 0 71 . -6.972 6.618 -1.342 1.00 95.98 71 A 1 ATOM 570 C CD2 . TYR A 0 71 . -7.036 5.642 -3.575 1.00 95.98 71 A 1 ATOM 571 C CE1 . TYR A 0 71 . -8.367 6.463 -1.231 1.00 95.98 71 A 1 ATOM 572 C CE2 . TYR A 0 71 . -8.428 5.475 -3.465 1.00 95.98 71 A 1 ATOM 573 O OH . TYR A 0 71 . -10.440 5.726 -2.196 1.00 95.98 71 A 1 ATOM 574 C CZ . TYR A 0 71 . -9.096 5.888 -2.295 1.00 95.98 71 A 1 ATOM 575 N N . TRP A 0 72 . -2.208 8.693 -3.628 1.00 97.13 72 A 1 ATOM 576 C CA . TRP A 0 72 . -0.765 8.913 -3.557 1.00 97.13 72 A 1 ATOM 577 C C . TRP A 0 72 . -0.379 9.710 -2.313 1.00 97.13 72 A 1 ATOM 578 C CB . TRP A 0 72 . -0.263 9.616 -4.815 1.00 97.13 72 A 1 ATOM 579 O O . TRP A 0 72 . -0.972 10.739 -2.001 1.00 97.13 72 A 1 ATOM 580 C CG . TRP A 0 72 . 1.193 9.931 -4.842 1.00 97.13 72 A 1 ATOM 581 C CD1 . TRP A 0 72 . 2.194 9.040 -5.026 1.00 97.13 72 A 1 ATOM 582 C CD2 . TRP A 0 72 . 1.823 11.234 -4.709 1.00 97.13 72 A 1 ATOM 583 C CE2 . TRP A 0 72 . 3.231 11.064 -4.859 1.00 97.13 72 A 1 ATOM 584 C CE3 . TRP A 0 72 . 1.344 12.541 -4.482 1.00 97.13 72 A 1 ATOM 585 N NE1 . TRP A 0 72 . 3.405 9.706 -5.044 1.00 97.13 72 A 1 ATOM 586 C CH2 . TRP A 0 72 . 3.615 13.435 -4.579 1.00 97.13 72 A 1 ATOM 587 C CZ2 . TRP A 0 72 . 4.123 12.144 -4.805 1.00 97.13 72 A 1 ATOM 588 C CZ3 . TRP A 0 72 . 2.231 13.630 -4.416 1.00 97.13 72 A 1 ATOM 589 N N . LEU A 0 73 . 0.640 9.220 -1.611 1.00 96.76 73 A 1 ATOM 590 C CA . LEU A 0 73 . 1.232 9.906 -0.467 1.00 96.76 73 A 1 ATOM 591 C C . LEU A 0 73 . 2.557 10.552 -0.852 1.00 96.76 73 A 1 ATOM 592 C CB . LEU A 0 73 . 1.417 8.909 0.689 1.00 96.76 73 A 1 ATOM 593 O O . LEU A 0 73 . 2.742 11.752 -0.682 1.00 96.76 73 A 1 ATOM 594 C CG . LEU A 0 73 . 0.103 8.439 1.327 1.00 96.76 73 A 1 ATOM 595 C CD1 . LEU A 0 73 . 0.421 7.329 2.329 1.00 96.76 73 A 1 ATOM 596 C CD2 . LEU A 0 73 . -0.587 9.592 2.061 1.00 96.76 73 A 1 ATOM 597 N N . LYS A 0 74 . 3.504 9.734 -1.321 1.00 96.69 74 A 1 ATOM 598 C CA . LYS A 0 74 . 4.840 10.179 -1.723 1.00 96.69 74 A 1 ATOM 599 C C . LYS A 0 74 . 5.594 9.099 -2.486 1.00 96.69 74 A 1 ATOM 600 C CB . LYS A 0 74 . 5.657 10.636 -0.496 1.00 96.69 74 A 1 ATOM 601 O O . LYS A 0 74 . 5.247 7.917 -2.439 1.00 96.69 74 A 1 ATOM 602 C CG . LYS A 0 74 . 5.931 9.533 0.538 1.00 96.69 74 A 1 ATOM 603 C CD . LYS A 0 74 . 6.846 10.100 1.627 1.00 96.69 74 A 1 ATOM 604 C CE . LYS A 0 74 . 7.262 9.014 2.619 1.00 96.69 74 A 1 ATOM 605 N NZ . LYS A 0 74 . 8.357 9.502 3.494 1.00 96.69 74 A 1 ATOM 606 N N . THR A 0 75 . 6.692 9.513 -3.102 1.00 96.83 75 A 1 ATOM 607 C CA . THR A 0 75 . 7.725 8.629 -3.644 1.00 96.83 75 A 1 ATOM 608 C C . THR A 0 75 . 8.961 8.708 -2.752 1.00 96.83 75 A 1 ATOM 609 C CB . THR A 0 75 . 8.052 9.012 -5.091 1.00 96.83 75 A 1 ATOM 610 O O . THR A 0 75 . 9.374 9.798 -2.365 1.00 96.83 75 A 1 ATOM 611 C CG2 . THR A 0 75 . 9.021 8.032 -5.746 1.00 96.83 75 A 1 ATOM 612 O OG1 . THR A 0 75 . 6.866 8.999 -5.862 1.00 96.83 75 A 1 ATOM 613 N N . VAL A 0 76 . 9.535 7.562 -2.398 1.00 95.90 76 A 1 ATOM 614 C CA . VAL A 0 76 . 10.762 7.460 -1.600 1.00 95.90 76 A 1 ATOM 615 C C . VAL A 0 76 . 11.843 6.832 -2.462 1.00 95.90 76 A 1 ATOM 616 C CB . VAL A 0 76 . 10.533 6.630 -0.321 1.00 95.90 76 A 1 ATOM 617 O O . VAL A 0 76 . 11.671 5.702 -2.914 1.00 95.90 76 A 1 ATOM 618 C CG1 . VAL A 0 76 . 11.795 6.582 0.549 1.00 95.90 76 A 1 ATOM 619 C CG2 . VAL A 0 76 . 9.400 7.217 0.533 1.00 95.90 76 A 1 ATOM 620 N N . GLU A 0 77 . 12.944 7.546 -2.676 1.00 94.71 77 A 1 ATOM 621 C CA . GLU A 0 77 . 14.148 6.982 -3.282 1.00 94.71 77 A 1 ATOM 622 C C . GLU A 0 77 . 14.880 6.134 -2.241 1.00 94.71 77 A 1 ATOM 623 C CB . GLU A 0 77 . 15.034 8.105 -3.820 1.00 94.71 77 A 1 ATOM 624 O O . GLU A 0 77 . 15.292 6.626 -1.188 1.00 94.71 77 A 1 ATOM 625 C CG . GLU A 0 77 . 16.217 7.531 -4.615 1.00 94.71 77 A 1 ATOM 626 C CD . GLU A 0 77 . 17.130 8.620 -5.192 1.00 94.71 77 A 1 ATOM 627 O OE1 . GLU A 0 77 . 18.207 8.233 -5.697 1.00 94.71 77 A 1 ATOM 628 O OE2 . GLU A 0 77 . 16.749 9.810 -5.121 1.00 94.71 77 A 1 ATOM 629 N N . THR A 0 78 . 14.969 4.831 -2.484 1.00 89.89 78 A 1 ATOM 630 C CA . THR A 0 78 . 15.575 3.897 -1.538 1.00 89.89 78 A 1 ATOM 631 C C . THR A 0 78 . 15.829 2.544 -2.187 1.00 89.89 78 A 1 ATOM 632 C CB . THR A 0 78 . 14.693 3.734 -0.289 1.00 89.89 78 A 1 ATOM 633 O O . THR A 0 78 . 15.041 2.074 -3.003 1.00 89.89 78 A 1 ATOM 634 C CG2 . THR A 0 78 . 13.328 3.104 -0.554 1.00 89.89 78 A 1 ATOM 635 O OG1 . THR A 0 78 . 15.373 2.965 0.677 1.00 89.89 78 A 1 ATOM 636 N N . LYS A 0 79 . 16.919 1.895 -1.768 1.00 86.17 79 A 1 ATOM 637 C CA . LYS A 0 79 . 17.197 0.482 -2.070 1.00 86.17 79 A 1 ATOM 638 C C . LYS A 0 79 . 16.600 -0.468 -1.023 1.00 86.17 79 A 1 ATOM 639 C CB . LYS A 0 79 . 18.711 0.264 -2.210 1.00 86.17 79 A 1 ATOM 640 O O . LYS A 0 79 . 16.704 -1.681 -1.170 1.00 86.17 79 A 1 ATOM 641 C CG . LYS A 0 79 . 19.318 1.065 -3.372 1.00 86.17 79 A 1 ATOM 642 C CD . LYS A 0 79 . 20.816 0.761 -3.501 1.00 86.17 79 A 1 ATOM 643 C CE . LYS A 0 79 . 21.419 1.585 -4.645 1.00 86.17 79 A 1 ATOM 644 N NZ . LYS A 0 79 . 22.882 1.363 -4.764 1.00 86.17 79 A 1 ATOM 645 N N . SER A 0 80 . 16.023 0.072 0.051 1.00 87.18 80 A 1 ATOM 646 C CA . SER A 0 80 . 15.385 -0.707 1.113 1.00 87.18 80 A 1 ATOM 647 C C . SER A 0 80 . 14.055 -1.279 0.642 1.00 87.18 80 A 1 ATOM 648 C CB . SER A 0 80 . 15.128 0.163 2.345 1.00 87.18 80 A 1 ATOM 649 O O . SER A 0 80 . 13.377 -0.663 -0.175 1.00 87.18 80 A 1 ATOM 650 O OG . SER A 0 80 . 16.344 0.691 2.838 1.00 87.18 80 A 1 ATOM 651 N N . ASP A 0 81 . 13.651 -2.413 1.217 1.00 91.44 81 A 1 ATOM 652 C CA . ASP A 0 81 . 12.358 -3.058 0.964 1.00 91.44 81 A 1 ATOM 653 C C . ASP A 0 81 . 11.175 -2.077 1.134 1.00 91.44 81 A 1 ATOM 654 C CB . ASP A 0 81 . 12.236 -4.281 1.883 1.00 91.44 81 A 1 ATOM 655 O O . ASP A 0 81 . 10.970 -1.502 2.209 1.00 91.44 81 A 1 ATOM 656 C CG . ASP A 0 81 . 10.985 -5.131 1.629 1.00 91.44 81 A 1 ATOM 657 O OD1 . ASP A 0 81 . 10.074 -4.656 0.913 1.00 91.44 81 A 1 ATOM 658 O OD2 . ASP A 0 81 . 10.906 -6.213 2.241 1.00 91.44 81 A 1 ATOM 659 N N . CYS A 0 82 . 10.363 -1.902 0.085 1.00 95.59 82 A 1 ATOM 660 C CA . CYS A 0 82 . 9.205 -1.017 0.101 1.00 95.59 82 A 1 ATOM 661 C C . CYS A 0 82 . 8.137 -1.446 1.111 1.00 95.59 82 A 1 ATOM 662 C CB . CYS A 0 82 . 8.601 -0.922 -1.301 1.00 95.59 82 A 1 ATOM 663 O O . CYS A 0 82 . 7.425 -0.580 1.628 1.00 95.59 82 A 1 ATOM 664 S SG . CYS A 0 82 . 9.661 -0.174 -2.559 1.00 95.59 82 A 1 ATOM 665 N N . LEU A 0 83 . 8.063 -2.734 1.469 1.00 95.05 83 A 1 ATOM 666 C CA . LEU A 0 83 . 7.231 -3.200 2.576 1.00 95.05 83 A 1 ATOM 667 C C . LEU A 0 83 . 7.644 -2.526 3.884 1.00 95.05 83 A 1 ATOM 668 C CB . LEU A 0 83 . 7.377 -4.726 2.712 1.00 95.05 83 A 1 ATOM 669 O O . LEU A 0 83 . 6.798 -2.048 4.642 1.00 95.05 83 A 1 ATOM 670 C CG . LEU A 0 83 . 6.599 -5.333 3.890 1.00 95.05 83 A 1 ATOM 671 C CD1 . LEU A 0 83 . 5.094 -5.089 3.795 1.00 95.05 83 A 1 ATOM 672 C CD2 . LEU A 0 83 . 6.847 -6.836 3.953 1.00 95.05 83 A 1 ATOM 673 N N . ILE A 0 84 . 8.948 -2.480 4.156 1.00 94.84 84 A 1 ATOM 674 C CA . ILE A 0 84 . 9.503 -1.881 5.370 1.00 94.84 84 A 1 ATOM 675 C C . ILE A 0 84 . 9.247 -0.372 5.360 1.00 94.84 84 A 1 ATOM 676 C CB . ILE A 0 84 . 11.002 -2.239 5.502 1.00 94.84 84 A 1 ATOM 677 O O . ILE A 0 84 . 8.715 0.170 6.330 1.00 94.84 84 A 1 ATOM 678 C CG1 . ILE A 0 84 . 11.169 -3.768 5.661 1.00 94.84 84 A 1 ATOM 679 C CG2 . ILE A 0 84 . 11.616 -1.507 6.699 1.00 94.84 84 A 1 ATOM 680 C CD1 . ILE A 0 84 . 12.626 -4.236 5.787 1.00 94.84 84 A 1 ATOM 681 N N . VAL A 0 85 . 9.543 0.287 4.239 1.00 95.45 85 A 1 ATOM 682 C CA . VAL A 0 85 . 9.329 1.731 4.051 1.00 95.45 85 A 1 ATOM 683 C C . VAL A 0 85 . 7.860 2.104 4.265 1.00 95.45 85 A 1 ATOM 684 C CB . VAL A 0 85 . 9.796 2.147 2.646 1.00 95.45 85 A 1 ATOM 685 O O . VAL A 0 85 . 7.563 3.069 4.970 1.00 95.45 85 A 1 ATOM 686 C CG1 . VAL A 0 85 . 9.531 3.627 2.347 1.00 95.45 85 A 1 ATOM 687 C CG2 . VAL A 0 85 . 11.298 1.897 2.463 1.00 95.45 85 A 1 ATOM 688 N N . CYS A 0 86 . 6.933 1.317 3.716 1.00 95.51 86 A 1 ATOM 689 C CA . CYS A 0 86 . 5.503 1.525 3.911 1.00 95.51 86 A 1 ATOM 690 C C . CYS A 0 86 . 5.092 1.289 5.372 1.00 95.51 86 A 1 ATOM 691 C CB . CYS A 0 86 . 4.736 0.616 2.947 1.00 95.51 86 A 1 ATOM 692 O O . CYS A 0 86 . 4.383 2.106 5.949 1.00 95.51 86 A 1 ATOM 693 S SG . CYS A 0 86 . 2.936 0.844 2.930 1.00 95.51 86 A 1 ATOM 694 N N . ARG A 0 87 . 5.583 0.231 6.028 1.00 92.21 87 A 1 ATOM 695 C CA . ARG A 0 87 . 5.248 -0.063 7.435 1.00 92.21 87 A 1 ATOM 696 C C . ARG A 0 87 . 5.698 1.016 8.419 1.00 92.21 87 A 1 ATOM 697 C CB . ARG A 0 87 . 5.851 -1.410 7.838 1.00 92.21 87 A 1 ATOM 698 O O . ARG A 0 87 . 5.030 1.193 9.435 1.00 92.21 87 A 1 ATOM 699 C CG . ARG A 0 87 . 5.036 -2.580 7.272 1.00 92.21 87 A 1 ATOM 700 C CD . ARG A 0 87 . 5.710 -3.915 7.591 1.00 92.21 87 A 1 ATOM 701 N NE . ARG A 0 87 . 5.711 -4.176 9.046 1.00 92.21 87 A 1 ATOM 702 N NH1 . ARG A 0 87 . 6.604 -6.282 8.954 1.00 92.21 87 A 1 ATOM 703 N NH2 . ARG A 0 87 . 6.131 -5.360 10.938 1.00 92.21 87 A 1 ATOM 704 C CZ . ARG A 0 87 . 6.144 -5.270 9.636 1.00 92.21 87 A 1 ATOM 705 N N . PHE A 0 88 . 6.798 1.711 8.136 1.00 92.30 88 A 1 ATOM 706 C CA . PHE A 0 88 . 7.265 2.842 8.944 1.00 92.30 88 A 1 ATOM 707 C C . PHE A 0 88 . 6.559 4.162 8.619 1.00 92.30 88 A 1 ATOM 708 C CB . PHE A 0 88 . 8.786 2.976 8.810 1.00 92.30 88 A 1 ATOM 709 O O . PHE A 0 88 . 6.744 5.146 9.334 1.00 92.30 88 A 1 ATOM 710 C CG . PHE A 0 88 . 9.553 1.921 9.580 1.00 92.30 88 A 1 ATOM 711 C CD1 . PHE A 0 88 . 9.446 1.864 10.983 1.00 92.30 88 A 1 ATOM 712 C CD2 . PHE A 0 88 . 10.415 1.034 8.915 1.00 92.30 88 A 1 ATOM 713 C CE1 . PHE A 0 88 . 10.175 0.909 11.713 1.00 92.30 88 A 1 ATOM 714 C CE2 . PHE A 0 88 . 11.161 0.094 9.649 1.00 92.30 88 A 1 ATOM 715 C CZ . PHE A 0 88 . 11.031 0.020 11.044 1.00 92.30 88 A 1 ATOM 716 N N . HIS A 0 89 . 5.732 4.202 7.574 1.00 92.62 89 A 1 ATOM 717 C CA . HIS A 0 89 . 4.949 5.376 7.233 1.00 92.62 89 A 1 ATOM 718 C C . HIS A 0 89 . 3.500 5.206 7.727 1.00 92.62 89 A 1 ATOM 719 C CB . HIS A 0 89 . 5.066 5.636 5.731 1.00 92.62 89 A 1 ATOM 720 O O . HIS A 0 89 . 2.769 4.374 7.194 1.00 92.62 89 A 1 ATOM 721 C CG . HIS A 0 89 . 4.663 7.042 5.392 1.00 92.62 89 A 1 ATOM 722 C CD2 . HIS A 0 89 . 3.507 7.443 4.787 1.00 92.62 89 A 1 ATOM 723 N ND1 . HIS A 0 89 . 5.370 8.177 5.726 1.00 92.62 89 A 1 ATOM 724 C CE1 . HIS A 0 89 . 4.653 9.241 5.328 1.00 92.62 89 A 1 ATOM 725 N NE2 . HIS A 0 89 . 3.521 8.836 4.740 1.00 92.62 89 A 1 ATOM 726 N N . PRO A 0 90 . 3.041 5.985 8.725 1.00 89.00 90 A 1 ATOM 727 C CA . PRO A 0 90 . 1.804 5.698 9.465 1.00 89.00 90 A 1 ATOM 728 C C . PRO A 0 90 . 0.534 5.720 8.603 1.00 89.00 90 A 1 ATOM 729 C CB . PRO A 0 90 . 1.747 6.756 10.575 1.00 89.00 90 A 1 ATOM 730 O O . PRO A 0 90 . -0.446 5.058 8.934 1.00 89.00 90 A 1 ATOM 731 C CG . PRO A 0 90 . 2.610 7.901 10.046 1.00 89.00 90 A 1 ATOM 732 C CD . PRO A 0 90 . 3.693 7.168 9.263 1.00 89.00 90 A 1 ATOM 733 N N . GLN A 0 91 . 0.552 6.463 7.495 1.00 92.09 91 A 1 ATOM 734 C CA . GLN A 0 91 . -0.567 6.561 6.559 1.00 92.09 91 A 1 ATOM 735 C C . GLN A 0 91 . -0.488 5.549 5.407 1.00 92.09 91 A 1 ATOM 736 C CB . GLN A 0 91 . -0.634 7.998 6.023 1.00 92.09 91 A 1 ATOM 737 O O . GLN A 0 91 . -1.457 5.420 4.663 1.00 92.09 91 A 1 ATOM 738 C CG . GLN A 0 91 . -0.988 9.012 7.125 1.00 92.09 91 A 1 ATOM 739 C CD . GLN A 0 91 . -1.057 10.439 6.592 1.00 92.09 91 A 1 ATOM 740 N NE2 . GLN A 0 91 . -1.743 11.335 7.267 1.00 92.09 91 A 1 ATOM 741 O OE1 . GLN A 0 91 . -0.489 10.781 5.574 1.00 92.09 91 A 1 ATOM 742 N N . CYS A 0 92 . 0.633 4.836 5.241 1.00 94.15 92 A 1 ATOM 743 C CA . CYS A 0 92 . 0.819 3.927 4.117 1.00 94.15 92 A 1 ATOM 744 C C . CYS A 0 92 . 0.098 2.596 4.344 1.00 94.15 92 A 1 ATOM 745 C CB . CYS A 0 92 . 2.305 3.724 3.830 1.00 94.15 92 A 1 ATOM 746 O O . CYS A 0 92 . 0.281 1.923 5.364 1.00 94.15 92 A 1 ATOM 747 S SG . CYS A 0 92 . 2.641 2.763 2.331 1.00 94.15 92 A 1 ATOM 748 N N . LYS A 0 93 . -0.711 2.207 3.360 1.00 92.57 93 A 1 ATOM 749 C CA . LYS A 0 93 . -1.468 0.945 3.352 1.00 92.57 93 A 1 ATOM 750 C C . LYS A 0 93 . -1.202 0.104 2.103 1.00 92.57 93 A 1 ATOM 751 C CB . LYS A 0 93 . -2.965 1.245 3.489 1.00 92.57 93 A 1 ATOM 752 O O . LYS A 0 93 . -1.442 -1.104 2.126 1.00 92.57 93 A 1 ATOM 753 C CG . LYS A 0 93 . -3.320 2.142 4.687 1.00 92.57 93 A 1 ATOM 754 C CD . LYS A 0 93 . -4.841 2.225 4.836 1.00 92.57 93 A 1 ATOM 755 C CE . LYS A 0 93 . -5.280 3.426 5.680 1.00 92.57 93 A 1 ATOM 756 N NZ . LYS A 0 93 . -6.493 4.049 5.094 1.00 92.57 93 A 1 ATOM 757 N N . LEU A 0 94 . -0.675 0.730 1.053 1.00 95.28 94 A 1 ATOM 758 C CA . LEU A 0 94 . -0.300 0.108 -0.210 1.00 95.28 94 A 1 ATOM 759 C C . LEU A 0 94 . 0.963 0.786 -0.748 1.00 95.28 94 A 1 ATOM 760 C CB . LEU A 0 94 . -1.523 0.174 -1.147 1.00 95.28 94 A 1 ATOM 761 O O . LEU A 0 94 . 1.184 1.977 -0.529 1.00 95.28 94 A 1 ATOM 762 C CG . LEU A 0 94 . -1.384 -0.514 -2.521 1.00 95.28 94 A 1 ATOM 763 C CD1 . LEU A 0 94 . -2.764 -0.961 -3.002 1.00 95.28 94 A 1 ATOM 764 C CD2 . LEU A 0 94 . -0.792 0.405 -3.593 1.00 95.28 94 A 1 ATOM 765 N N . TYR A 0 95 . 1.811 0.031 -1.430 1.00 96.55 95 A 1 ATOM 766 C CA . TYR A 0 95 . 3.001 0.534 -2.095 1.00 96.55 95 A 1 ATOM 767 C C . TYR A 0 95 . 3.192 -0.138 -3.452 1.00 96.55 95 A 1 ATOM 768 C CB . TYR A 0 95 . 4.232 0.345 -1.199 1.00 96.55 95 A 1 ATOM 769 O O . TYR A 0 95 . 2.722 -1.250 -3.678 1.00 96.55 95 A 1 ATOM 770 C CG . TYR A 0 95 . 4.592 -1.106 -0.937 1.00 96.55 95 A 1 ATOM 771 C CD1 . TYR A 0 95 . 4.040 -1.778 0.169 1.00 96.55 95 A 1 ATOM 772 C CD2 . TYR A 0 95 . 5.452 -1.789 -1.819 1.00 96.55 95 A 1 ATOM 773 C CE1 . TYR A 0 95 . 4.360 -3.127 0.404 1.00 96.55 95 A 1 ATOM 774 C CE2 . TYR A 0 95 . 5.786 -3.135 -1.581 1.00 96.55 95 A 1 ATOM 775 O OH . TYR A 0 95 . 5.537 -5.103 -0.246 1.00 96.55 95 A 1 ATOM 776 C CZ . TYR A 0 95 . 5.244 -3.800 -0.464 1.00 96.55 95 A 1 ATOM 777 N N . THR A 0 96 . 3.928 0.523 -4.339 1.00 95.21 96 A 1 ATOM 778 C CA . THR A 0 96 . 4.331 -0.045 -5.630 1.00 95.21 96 A 1 ATOM 779 C C . THR A 0 96 . 5.808 0.202 -5.885 1.00 95.21 96 A 1 ATOM 780 C CB . THR A 0 96 . 3.518 0.508 -6.810 1.00 95.21 96 A 1 ATOM 781 O O . THR A 0 96 . 6.314 1.283 -5.559 1.00 95.21 96 A 1 ATOM 782 C CG2 . THR A 0 96 . 2.009 0.407 -6.615 1.00 95.21 96 A 1 ATOM 783 O OG1 . THR A 0 96 . 3.840 1.863 -7.019 1.00 95.21 96 A 1 ATOM 784 N N . HIS A 0 97 . 6.478 -0.746 -6.530 1.00 94.45 97 A 1 ATOM 785 C CA . HIS A 0 97 . 7.848 -0.585 -7.014 1.00 94.45 97 A 1 ATOM 786 C C . HIS A 0 97 . 8.088 -1.393 -8.288 1.00 94.45 97 A 1 ATOM 787 C CB . HIS A 0 97 . 8.838 -1.004 -5.927 1.00 94.45 97 A 1 ATOM 788 O O . HIS A 0 97 . 7.324 -2.300 -8.610 1.00 94.45 97 A 1 ATOM 789 C CG . HIS A 0 97 . 8.798 -2.473 -5.587 1.00 94.45 97 A 1 ATOM 790 C CD2 . HIS A 0 97 . 7.959 -3.074 -4.691 1.00 94.45 97 A 1 ATOM 791 N ND1 . HIS A 0 97 . 9.587 -3.465 -6.123 1.00 94.45 97 A 1 ATOM 792 C CE1 . HIS A 0 97 . 9.248 -4.625 -5.539 1.00 94.45 97 A 1 ATOM 793 N NE2 . HIS A 0 97 . 8.246 -4.439 -4.663 1.00 94.45 97 A 1 ATOM 794 N N . LYS A 0 98 . 9.165 -1.073 -9.009 1.00 92.11 98 A 1 ATOM 795 C CA . LYS A 0 98 . 9.620 -1.895 -10.135 1.00 92.11 98 A 1 ATOM 796 C C . LYS A 0 98 . 10.140 -3.236 -9.615 1.00 92.11 98 A 1 ATOM 797 C CB . LYS A 0 98 . 10.708 -1.165 -10.932 1.00 92.11 98 A 1 ATOM 798 O O . LYS A 0 98 . 10.905 -3.263 -8.650 1.00 92.11 98 A 1 ATOM 799 C CG . LYS A 0 98 . 10.170 0.049 -11.703 1.00 92.11 98 A 1 ATOM 800 C CD . LYS A 0 98 . 11.287 0.669 -12.554 1.00 92.11 98 A 1 ATOM 801 C CE . LYS A 0 98 . 10.737 1.809 -13.418 1.00 92.11 98 A 1 ATOM 802 N NZ . LYS A 0 98 . 11.791 2.388 -14.290 1.00 92.11 98 A 1 ATOM 803 N N . ALA A 0 99 . 9.769 -4.325 -10.277 1.00 88.38 99 A 1 ATOM 804 C CA . ALA A 0 99 . 10.167 -5.687 -9.935 1.00 88.38 99 A 1 ATOM 805 C C . ALA A 0 99 . 11.671 -5.924 -10.144 1.00 88.38 99 A 1 ATOM 806 C CB . ALA A 0 99 . 9.358 -6.660 -10.804 1.00 88.38 99 A 1 ATOM 807 O O . ALA A 0 99 . 12.301 -6.608 -9.349 1.00 88.38 99 A 1 ATOM 808 N N . ILE A 0 100 . 12.245 -5.347 -11.207 1.00 85.20 100 A 1 ATOM 809 C CA . ILE A 0 100 . 13.627 -5.628 -11.630 1.00 85.20 100 A 1 ATOM 810 C C . ILE A 0 100 . 14.643 -4.832 -10.801 1.00 85.20 100 A 1 ATOM 811 C CB . ILE A 0 100 . 13.795 -5.360 -13.146 1.00 85.20 100 A 1 ATOM 812 O O . ILE A 0 100 . 15.661 -5.367 -10.370 1.00 85.20 100 A 1 ATOM 813 C CG1 . ILE A 0 100 . 12.760 -6.169 -13.966 1.00 85.20 100 A 1 ATOM 814 C CG2 . ILE A 0 100 . 15.229 -5.703 -13.599 1.00 85.20 100 A 1 ATOM 815 C CD1 . ILE A 0 100 . 12.786 -5.898 -15.476 1.00 85.20 100 A 1 ATOM 816 N N . LYS A 0 101 . 14.384 -3.537 -10.584 1.00 82.51 101 A 1 ATOM 817 C CA . LYS A 0 101 . 15.288 -2.650 -9.846 1.00 82.51 101 A 1 ATOM 818 C C . LYS A 0 101 . 14.493 -1.686 -8.980 1.00 82.51 101 A 1 ATOM 819 C CB . LYS A 0 101 . 16.228 -1.931 -10.824 1.00 82.51 101 A 1 ATOM 820 O O . LYS A 0 101 . 13.904 -0.719 -9.462 1.00 82.51 101 A 1 ATOM 821 C CG . LYS A 0 101 . 17.451 -1.351 -10.099 1.00 82.51 101 A 1 ATOM 822 C CD . LYS A 0 101 . 18.299 -0.540 -11.084 1.00 82.51 101 A 1 ATOM 823 C CE . LYS A 0 101 . 19.527 0.067 -10.398 1.00 82.51 101 A 1 ATOM 824 N NZ . LYS A 0 101 . 20.106 1.139 -11.239 1.00 82.51 101 A 1 ATOM 825 N N . GLN A 0 102 . 14.482 -1.965 -7.687 1.00 80.35 102 A 1 ATOM 826 C CA . GLN A 0 102 . 13.787 -1.156 -6.701 1.00 80.35 102 A 1 ATOM 827 C C . GLN A 0 102 . 14.622 0.080 -6.351 1.00 80.35 102 A 1 ATOM 828 C CB . GLN A 0 102 . 13.472 -2.057 -5.513 1.00 80.35 102 A 1 ATOM 829 O O . GLN A 0 102 . 15.453 0.058 -5.450 1.00 80.35 102 A 1 ATOM 830 C CG . GLN A 0 102 . 12.580 -1.371 -4.477 1.00 80.35 102 A 1 ATOM 831 C CD . GLN A 0 102 . 12.169 -2.392 -3.436 1.00 80.35 102 A 1 ATOM 832 N NE2 . GLN A 0 102 . 12.270 -2.109 -2.174 1.00 80.35 102 A 1 ATOM 833 O OE1 . GLN A 0 102 . 11.799 -3.516 -3.713 1.00 80.35 102 A 1 ATOM 834 N N . GLU A 0 103 . 14.432 1.143 -7.128 1.00 87.95 103 A 1 ATOM 835 C CA . GLU A 0 103 . 15.031 2.465 -6.876 1.00 87.95 103 A 1 ATOM 836 C C . GLU A 0 103 . 14.065 3.386 -6.125 1.00 87.95 103 A 1 ATOM 837 C CB . GLU A 0 103 . 15.423 3.106 -8.215 1.00 87.95 103 A 1 ATOM 838 O O . GLU A 0 103 . 14.477 4.240 -5.343 1.00 87.95 103 A 1 ATOM 839 C CG . GLU A 0 103 . 16.485 2.288 -8.959 1.00 87.95 103 A 1 ATOM 840 C CD . GLU A 0 103 . 16.849 2.877 -10.326 1.00 87.95 103 A 1 ATOM 841 O OE1 . GLU A 0 103 . 18.033 2.709 -10.711 1.00 87.95 103 A 1 ATOM 842 O OE2 . GLU A 0 103 . 15.941 3.365 -11.032 1.00 87.95 103 A 1 ATOM 843 N N . PHE A 0 104 . 12.764 3.189 -6.351 1.00 93.19 104 A 1 ATOM 844 C CA . PHE A 0 104 . 11.709 4.033 -5.815 1.00 93.19 104 A 1 ATOM 845 C C . PHE A 0 104 . 10.572 3.194 -5.245 1.00 93.19 104 A 1 ATOM 846 C CB . PHE A 0 104 . 11.184 4.980 -6.901 1.00 93.19 104 A 1 ATOM 847 O O . PHE A 0 104 . 10.047 2.297 -5.911 1.00 93.19 104 A 1 ATOM 848 C CG . PHE A 0 104 . 12.245 5.877 -7.508 1.00 93.19 104 A 1 ATOM 849 C CD1 . PHE A 0 104 . 12.638 7.058 -6.850 1.00 93.19 104 A 1 ATOM 850 C CD2 . PHE A 0 104 . 12.876 5.502 -8.709 1.00 93.19 104 A 1 ATOM 851 C CE1 . PHE A 0 104 . 13.657 7.860 -7.395 1.00 93.19 104 A 1 ATOM 852 C CE2 . PHE A 0 104 . 13.906 6.294 -9.244 1.00 93.19 104 A 1 ATOM 853 C CZ . PHE A 0 104 . 14.294 7.475 -8.587 1.00 93.19 104 A 1 ATOM 854 N N . CYS A 0 105 . 10.136 3.564 -4.045 1.00 95.79 105 A 1 ATOM 855 C CA . CYS A 0 105 . 8.897 3.097 -3.442 1.00 95.79 105 A 1 ATOM 856 C C . CYS A 0 105 . 7.845 4.195 -3.568 1.00 95.79 105 A 1 ATOM 857 C CB . CYS A 0 105 . 9.147 2.748 -1.972 1.00 95.79 105 A 1 ATOM 858 O O . CYS A 0 105 . 7.988 5.262 -2.965 1.00 95.79 105 A 1 ATOM 859 S SG . CYS A 0 105 . 10.421 1.499 -1.698 1.00 95.79 105 A 1 ATOM 860 N N . LYS A 0 106 . 6.771 3.946 -4.317 1.00 96.48 106 A 1 ATOM 861 C CA . LYS A 0 106 . 5.595 4.826 -4.289 1.00 96.48 106 A 1 ATOM 862 C C . LYS A 0 106 . 4.647 4.326 -3.210 1.00 96.48 106 A 1 ATOM 863 C CB . LYS A 0 106 . 4.901 4.894 -5.648 1.00 96.48 106 A 1 ATOM 864 O O . LYS A 0 106 . 4.346 3.136 -3.180 1.00 96.48 106 A 1 ATOM 865 C CG . LYS A 0 106 . 5.812 5.346 -6.798 1.00 96.48 106 A 1 ATOM 866 C CD . LYS A 0 106 . 5.001 5.418 -8.098 1.00 96.48 106 A 1 ATOM 867 C CE . LYS A 0 106 . 5.864 5.889 -9.274 1.00 96.48 106 A 1 ATOM 868 N NZ . LYS A 0 106 . 5.081 5.923 -10.539 1.00 96.48 106 A 1 ATOM 869 N N . LEU A 0 107 . 4.224 5.213 -2.316 1.00 97.37 107 A 1 ATOM 870 C CA . LEU A 0 107 . 3.389 4.890 -1.160 1.00 97.37 107 A 1 ATOM 871 C C . LEU A 0 107 . 1.986 5.470 -1.336 1.00 97.37 107 A 1 ATOM 872 C CB . LEU A 0 107 . 4.037 5.437 0.123 1.00 97.37 107 A 1 ATOM 873 O O . LEU A 0 107 . 1.836 6.586 -1.840 1.00 97.37 107 A 1 ATOM 874 C CG . LEU A 0 107 . 5.503 5.037 0.374 1.00 97.37 107 A 1 ATOM 875 C CD1 . LEU A 0 107 . 5.905 5.539 1.763 1.00 97.37 107 A 1 ATOM 876 C CD2 . LEU A 0 107 . 5.767 3.531 0.305 1.00 97.37 107 A 1 ATOM 877 N N . TYR A 0 108 . 0.982 4.739 -0.857 1.00 96.75 108 A 1 ATOM 878 C CA . TYR A 0 108 . -0.430 5.076 -1.008 1.00 96.75 108 A 1 ATOM 879 C C . TYR A 0 108 . -1.208 4.859 0.296 1.00 96.75 108 A 1 ATOM 880 C CB . TYR A 0 108 . -1.049 4.258 -2.154 1.00 96.75 108 A 1 ATOM 881 O O . TYR A 0 108 . -0.915 3.944 1.074 1.00 96.75 108 A 1 ATOM 882 C CG . TYR A 0 108 . -0.315 4.372 -3.477 1.00 96.75 108 A 1 ATOM 883 C CD1 . TYR A 0 108 . -0.675 5.367 -4.403 1.00 96.75 108 A 1 ATOM 884 C CD2 . TYR A 0 108 . 0.763 3.510 -3.760 1.00 96.75 108 A 1 ATOM 885 C CE1 . TYR A 0 108 . 0.067 5.532 -5.585 1.00 96.75 108 A 1 ATOM 886 C CE2 . TYR A 0 108 . 1.504 3.668 -4.944 1.00 96.75 108 A 1 ATOM 887 O OH . TYR A 0 108 . 1.898 4.889 -6.975 1.00 96.75 108 A 1 ATOM 888 C CZ . TYR A 0 108 . 1.162 4.686 -5.854 1.00 96.75 108 A 1 ATOM 889 N N . SER A 0 109 . -2.223 5.692 0.526 1.00 94.36 109 A 1 ATOM 890 C CA . SER A 0 109 . -3.115 5.637 1.698 1.00 94.36 109 A 1 ATOM 891 C C . SER A 0 109 . -4.351 4.752 1.508 1.00 94.36 109 A 1 ATOM 892 C CB . SER A 0 109 . -3.558 7.057 2.054 1.00 94.36 109 A 1 ATOM 893 O O . SER A 0 109 . -5.048 4.429 2.480 1.00 94.36 109 A 1 ATOM 894 O OG . SER A 0 109 . -4.267 7.623 0.970 1.00 94.36 109 A 1 ATOM 895 N N . GLY A 0 110 . -4.621 4.371 0.259 1.00 92.38 110 A 1 ATOM 896 C CA . GLY A 0 110 . -5.732 3.521 -0.151 1.00 92.38 110 A 1 ATOM 897 C C . GLY A 0 110 . -5.489 2.048 0.169 1.00 92.38 110 A 1 ATOM 898 O O . GLY A 0 110 . -4.352 1.597 0.308 1.00 92.38 110 A 1 ATOM 899 N N . LEU A 0 111 . -6.580 1.298 0.306 1.00 88.99 111 A 1 ATOM 900 C CA . LEU A 0 111 . -6.554 -0.135 0.594 1.00 88.99 111 A 1 ATOM 901 C C . LEU A 0 111 . -6.489 -0.961 -0.688 1.00 88.99 111 A 1 ATOM 902 C CB . LEU A 0 111 . -7.798 -0.512 1.412 1.00 88.99 111 A 1 ATOM 903 O O . LEU A 0 111 . -7.038 -0.560 -1.711 1.00 88.99 111 A 1 ATOM 904 C CG . LEU A 0 111 . -7.830 0.111 2.813 1.00 88.99 111 A 1 ATOM 905 C CD1 . LEU A 0 111 . -9.156 -0.213 3.480 1.00 88.99 111 A 1 ATOM 906 C CD2 . LEU A 0 111 . -6.707 -0.429 3.699 1.00 88.99 111 A 1 ATOM 907 N N . MET A 0 112 . -5.880 -2.145 -0.592 1.00 86.23 112 A 1 ATOM 908 C CA . MET A 0 112 . -5.836 -3.114 -1.691 1.00 86.23 112 A 1 ATOM 909 C C . MET A 0 112 . -7.246 -3.555 -2.130 1.00 86.23 112 A 1 ATOM 910 C CB . MET A 0 112 . -4.995 -4.319 -1.245 1.00 86.23 112 A 1 ATOM 911 O O . MET A 0 112 . -7.495 -3.748 -3.308 1.00 86.23 112 A 1 ATOM 912 C CG . MET A 0 112 . -4.746 -5.320 -2.379 1.00 86.23 112 A 1 ATOM 913 S SD . MET A 0 112 . -3.611 -4.757 -3.678 1.00 86.23 112 A 1 ATOM 914 C CE . MET A 0 112 . -2.013 -5.052 -2.881 1.00 86.23 112 A 1 ATOM 915 N N . GLU A 0 113 . -8.189 -3.654 -1.194 1.00 80.83 113 A 1 ATOM 916 C CA . GLU A 0 113 . -9.581 -4.056 -1.463 1.00 80.83 113 A 1 ATOM 917 C C . GLU A 0 113 . -10.350 -3.041 -2.331 1.00 80.83 113 A 1 ATOM 918 C CB . GLU A 0 113 . -10.288 -4.264 -0.108 1.00 80.83 113 A 1 ATOM 919 O O . GLU A 0 113 . -11.330 -3.399 -2.975 1.00 80.83 113 A 1 ATOM 920 C CG . GLU A 0 113 . -9.731 -5.483 0.661 1.00 80.83 113 A 1 ATOM 921 C CD . GLU A 0 113 . -10.099 -5.527 2.158 1.00 80.83 113 A 1 ATOM 922 O OE1 . GLU A 0 113 . -9.415 -6.292 2.890 1.00 80.83 113 A 1 ATOM 923 O OE2 . GLU A 0 113 . -10.966 -4.742 2.603 1.00 80.83 113 A 1 ATOM 924 N N . ASN A 0 114 . -9.887 -1.786 -2.390 1.00 83.00 114 A 1 ATOM 925 C CA . ASN A 0 114 . -10.546 -0.705 -3.130 1.00 83.00 114 A 1 ATOM 926 C C . ASN A 0 114 . -9.902 -0.450 -4.498 1.00 83.00 114 A 1 ATOM 927 C CB . ASN A 0 114 . -10.543 0.577 -2.279 1.00 83.00 114 A 1 ATOM 928 O O . ASN A 0 114 . -10.198 0.563 -5.133 1.00 83.00 114 A 1 ATOM 929 C CG . ASN A 0 114 . -11.351 0.489 -1.003 1.00 83.00 114 A 1 ATOM 930 N ND2 . ASN A 0 114 . -11.445 1.581 -0.280 1.00 83.00 114 A 1 ATOM 931 O OD1 . ASN A 0 114 . -11.893 -0.520 -0.606 1.00 83.00 114 A 1 ATOM 932 N N . THR A 0 115 . -8.970 -1.301 -4.927 1.00 81.86 115 A 1 ATOM 933 C CA . THR A 0 115 . -8.253 -1.110 -6.184 1.00 81.86 115 A 1 ATOM 934 C C . THR A 0 115 . -8.400 -2.298 -7.114 1.00 81.86 115 A 1 ATOM 935 C CB . THR A 0 115 . -6.790 -0.738 -5.951 1.00 81.86 115 A 1 ATOM 936 O O . THR A 0 115 . -8.546 -3.438 -6.688 1.00 81.86 115 A 1 ATOM 937 C CG2 . THR A 0 115 . -5.855 -1.841 -5.479 1.00 81.86 115 A 1 ATOM 938 O OG1 . THR A 0 115 . -6.273 -0.232 -7.150 1.00 81.86 115 A 1 ATOM 939 N N . THR A 0 116 . -8.332 -2.012 -8.408 1.00 86.25 116 A 1 ATOM 940 C CA . THR A 0 116 . -8.120 -3.017 -9.447 1.00 86.25 116 A 1 ATOM 941 C C . THR A 0 116 . -6.659 -2.949 -9.864 1.00 86.25 116 A 1 ATOM 942 C CB . THR A 0 116 . -9.057 -2.773 -10.631 1.00 86.25 116 A 1 ATOM 943 O O . THR A 0 116 . -6.149 -1.865 -10.162 1.00 86.25 116 A 1 ATOM 944 C CG2 . THR A 0 116 . -8.922 -3.830 -11.722 1.00 86.25 116 A 1 ATOM 945 O OG1 . THR A 0 116 . -10.386 -2.806 -10.169 1.00 86.25 116 A 1 ATOM 946 N N . ILE A 0 117 . -5.985 -4.098 -9.859 1.00 84.85 117 A 1 ATOM 947 C CA . ILE A 0 117 . -4.592 -4.216 -10.287 1.00 84.85 117 A 1 ATOM 948 C C . ILE A 0 117 . -4.567 -4.613 -11.762 1.00 84.85 117 A 1 ATOM 949 C CB . ILE A 0 117 . -3.816 -5.212 -9.395 1.00 84.85 117 A 1 ATOM 950 O O . ILE A 0 117 . -5.081 -5.666 -12.129 1.00 84.85 117 A 1 ATOM 951 C CG1 . ILE A 0 117 . -3.878 -4.860 -7.889 1.00 84.85 117 A 1 ATOM 952 C CG2 . ILE A 0 117 . -2.349 -5.322 -9.850 1.00 84.85 117 A 1 ATOM 953 C CD1 . ILE A 0 117 . -3.355 -3.467 -7.517 1.00 84.85 117 A 1 ATOM 954 N N . ASP A 0 118 . -3.952 -3.781 -12.598 1.00 84.21 118 A 1 ATOM 955 C CA . ASP A 0 118 . -3.596 -4.140 -13.964 1.00 84.21 118 A 1 ATOM 956 C C . ASP A 0 118 . -2.355 -5.040 -13.945 1.00 84.21 118 A 1 ATOM 957 C CB . ASP A 0 118 . -3.375 -2.881 -14.814 1.00 84.21 118 A 1 ATOM 958 O O . ASP A 0 118 . -1.224 -4.584 -13.751 1.00 84.21 118 A 1 ATOM 959 C CG . ASP A 0 118 . -3.018 -3.223 -16.267 1.00 84.21 118 A 1 ATOM 960 O OD1 . ASP A 0 118 . -3.091 -4.421 -16.636 1.00 84.21 118 A 1 ATOM 961 O OD2 . ASP A 0 118 . -2.659 -2.279 -17.000 1.00 84.21 118 A 1 ATOM 962 N N . THR A 0 119 . -2.579 -6.339 -14.135 1.00 79.01 119 A 1 ATOM 963 C CA . THR A 0 119 . -1.523 -7.355 -14.205 1.00 79.01 119 A 1 ATOM 964 C C . THR A 0 119 . -0.806 -7.381 -15.556 1.00 79.01 119 A 1 ATOM 965 C CB . THR A 0 119 . -2.095 -8.750 -13.915 1.00 79.01 119 A 1 ATOM 966 O O . THR A 0 119 . 0.242 -8.014 -15.664 1.00 79.01 119 A 1 ATOM 967 C CG2 . THR A 0 119 . -2.727 -8.845 -12.523 1.00 79.01 119 A 1 ATOM 968 O OG1 . THR A 0 119 . -3.106 -9.084 -14.844 1.00 79.01 119 A 1 ATOM 969 N N . ASN A 0 120 . -1.348 -6.714 -16.581 1.00 76.70 120 A 1 ATOM 970 C CA . ASN A 0 120 . -0.812 -6.711 -17.944 1.00 76.70 120 A 1 ATOM 971 C C . ASN A 0 120 . 0.146 -5.540 -18.203 1.00 76.70 120 A 1 ATOM 972 C CB . ASN A 0 120 . -1.977 -6.727 -18.948 1.00 76.70 120 A 1 ATOM 973 O O . ASN A 0 120 . 0.623 -5.376 -19.327 1.00 76.70 120 A 1 ATOM 974 C CG . ASN A 0 120 . -2.752 -8.028 -18.959 1.00 76.70 120 A 1 ATOM 975 N ND2 . ASN A 0 120 . -3.898 -8.036 -19.597 1.00 76.70 120 A 1 ATOM 976 O OD1 . ASN A 0 120 . -2.357 -9.052 -18.423 1.00 76.70 120 A 1 ATOM 977 N N . SER A 0 121 . 0.448 -4.728 -17.185 1.00 65.21 121 A 1 ATOM 978 C CA . SER A 0 121 . 1.357 -3.594 -17.336 1.00 65.21 121 A 1 ATOM 979 C C . SER A 0 121 . 2.737 -4.057 -17.829 1.00 65.21 121 A 1 ATOM 980 C CB . SER A 0 121 . 1.472 -2.814 -16.019 1.00 65.21 121 A 1 ATOM 981 O O . SER A 0 121 . 3.366 -4.916 -17.204 1.00 65.21 121 A 1 ATOM 982 O OG . SER A 0 121 . 2.272 -3.514 -15.078 1.00 65.21 121 A 1 ATOM 983 N N . THR A 0 122 . 3.240 -3.438 -18.898 1.00 63.51 122 A 1 ATOM 984 C CA . THR A 0 122 . 4.569 -3.708 -19.480 1.00 63.51 122 A 1 ATOM 985 C C . THR A 0 122 . 5.721 -3.418 -18.524 1.00 63.51 122 A 1 ATOM 986 C CB . THR A 0 122 . 4.780 -2.841 -20.732 1.00 63.51 122 A 1 ATOM 987 O O . THR A 0 122 . 6.807 -3.972 -18.661 1.00 63.51 122 A 1 ATOM 988 C CG2 . THR A 0 122 . 3.937 -3.368 -21.895 1.00 63.51 122 A 1 ATOM 989 O OG1 . THR A 0 122 . 4.382 -1.502 -20.489 1.00 63.51 122 A 1 ATOM 990 N N . ASP A 0 123 . 5.497 -2.560 -17.533 1.00 68.88 123 A 1 ATOM 991 C CA . ASP A 0 123 . 6.582 -1.950 -16.770 1.00 68.88 123 A 1 ATOM 992 C C . ASP A 0 123 . 7.082 -2.803 -15.588 1.00 68.88 123 A 1 ATOM 993 C CB . ASP A 0 123 . 6.167 -0.541 -16.346 1.00 68.88 123 A 1 ATOM 994 O O . ASP A 0 123 . 7.847 -2.313 -14.752 1.00 68.88 123 A 1 ATOM 995 C CG . ASP A 0 123 . 5.863 0.431 -17.481 1.00 68.88 123 A 1 ATOM 996 O OD1 . ASP A 0 123 . 6.198 0.115 -18.644 1.00 68.88 123 A 1 ATOM 997 O OD2 . ASP A 0 123 . 5.318 1.503 -17.140 1.00 68.88 123 A 1 ATOM 998 N N . HIS A 0 124 . 6.669 -4.076 -15.514 1.00 86.42 124 A 1 ATOM 999 C CA . HIS A 0 124 . 7.050 -5.037 -14.474 1.00 86.42 124 A 1 ATOM 1000 C C . HIS A 0 124 . 7.007 -4.425 -13.071 1.00 86.42 124 A 1 ATOM 1001 C CB . HIS A 0 124 . 8.421 -5.656 -14.777 1.00 86.42 124 A 1 ATOM 1002 O O . HIS A 0 124 . 8.028 -4.302 -12.394 1.00 86.42 124 A 1 ATOM 1003 C CG . HIS A 0 124 . 8.450 -6.493 -16.020 1.00 86.42 124 A 1 ATOM 1004 C CD2 . HIS A 0 124 . 9.126 -6.208 -17.174 1.00 86.42 124 A 1 ATOM 1005 N ND1 . HIS A 0 124 . 7.836 -7.713 -16.194 1.00 86.42 124 A 1 ATOM 1006 C CE1 . HIS A 0 124 . 8.140 -8.153 -17.425 1.00 86.42 124 A 1 ATOM 1007 N NE2 . HIS A 0 124 . 8.943 -7.281 -18.049 1.00 86.42 124 A 1 ATOM 1008 N N . TYR A 0 125 . 5.827 -4.011 -12.629 1.00 91.43 125 A 1 ATOM 1009 C CA . TYR A 0 125 . 5.635 -3.507 -11.275 1.00 91.43 125 A 1 ATOM 1010 C C . TYR A 0 125 . 5.158 -4.599 -10.328 1.00 91.43 125 A 1 ATOM 1011 C CB . TYR A 0 125 . 4.693 -2.312 -11.301 1.00 91.43 125 A 1 ATOM 1012 O O . TYR A 0 125 . 4.562 -5.599 -10.726 1.00 91.43 125 A 1 ATOM 1013 C CG . TYR A 0 125 . 5.404 -1.002 -11.588 1.00 91.43 125 A 1 ATOM 1014 C CD1 . TYR A 0 125 . 5.874 -0.205 -10.529 1.00 91.43 125 A 1 ATOM 1015 C CD2 . TYR A 0 125 . 5.596 -0.581 -12.911 1.00 91.43 125 A 1 ATOM 1016 C CE1 . TYR A 0 125 . 6.574 0.989 -10.791 1.00 91.43 125 A 1 ATOM 1017 C CE2 . TYR A 0 125 . 6.251 0.638 -13.179 1.00 91.43 125 A 1 ATOM 1018 O OH . TYR A 0 125 . 7.471 2.545 -12.377 1.00 91.43 125 A 1 ATOM 1019 C CZ . TYR A 0 125 . 6.771 1.405 -12.125 1.00 91.43 125 A 1 ATOM 1020 N N . VAL A 0 126 . 5.426 -4.380 -9.049 1.00 92.13 126 A 1 ATOM 1021 C CA . VAL A 0 126 . 4.860 -5.142 -7.945 1.00 92.13 126 A 1 ATOM 1022 C C . VAL A 0 126 . 4.121 -4.171 -7.050 1.00 92.13 126 A 1 ATOM 1023 C CB . VAL A 0 126 . 5.944 -5.906 -7.169 1.00 92.13 126 A 1 ATOM 1024 O O . VAL A 0 126 . 4.655 -3.127 -6.662 1.00 92.13 126 A 1 ATOM 1025 C CG1 . VAL A 0 126 . 5.356 -6.666 -5.975 1.00 92.13 126 A 1 ATOM 1026 C CG2 . VAL A 0 126 . 6.639 -6.928 -8.073 1.00 92.13 126 A 1 ATOM 1027 N N . THR A 0 127 . 2.899 -4.546 -6.704 1.00 93.10 127 A 1 ATOM 1028 C CA . THR A 0 127 . 2.049 -3.826 -5.768 1.00 93.10 127 A 1 ATOM 1029 C C . THR A 0 127 . 1.919 -4.633 -4.497 1.00 93.10 127 A 1 ATOM 1030 C CB . THR A 0 127 . 0.683 -3.556 -6.385 1.00 93.10 127 A 1 ATOM 1031 O O . THR A 0 127 . 1.413 -5.750 -4.516 1.00 93.10 127 A 1 ATOM 1032 C CG2 . THR A 0 127 . -0.201 -2.754 -5.429 1.00 93.10 127 A 1 ATOM 1033 O OG1 . THR A 0 127 . 0.900 -2.757 -7.514 1.00 93.10 127 A 1 ATOM 1034 N N . GLY A 0 128 . 2.373 -4.072 -3.383 1.00 93.91 128 A 1 ATOM 1035 C CA . GLY A 0 128 . 2.198 -4.659 -2.065 1.00 93.91 128 A 1 ATOM 1036 C C . GLY A 0 128 . 1.185 -3.883 -1.247 1.00 93.91 128 A 1 ATOM 1037 O O . GLY A 0 128 . 1.114 -2.660 -1.324 1.00 93.91 128 A 1 ATOM 1038 N N . GLY A 0 129 . 0.393 -4.570 -0.437 1.00 93.27 129 A 1 ATOM 1039 C CA . GLY A 0 129 . -0.626 -3.906 0.364 1.00 93.27 129 A 1 ATOM 1040 C C . GLY A 0 129 . -1.143 -4.756 1.502 1.00 93.27 129 A 1 ATOM 1041 O O . GLY A 0 129 . -0.916 -5.967 1.570 1.00 93.27 129 A 1 ATOM 1042 N N . ARG A 0 130 . -1.819 -4.083 2.427 1.00 89.48 130 A 1 ATOM 1043 C CA . ARG A 0 130 . -2.464 -4.726 3.564 1.00 89.48 130 A 1 ATOM 1044 C C . ARG A 0 130 . -3.870 -5.179 3.179 1.00 89.48 130 A 1 ATOM 1045 C CB . ARG A 0 130 . -2.436 -3.760 4.751 1.00 89.48 130 A 1 ATOM 1046 O O . ARG A 0 130 . -4.645 -4.392 2.641 1.00 89.48 130 A 1 ATOM 1047 C CG . ARG A 0 130 . -2.876 -4.458 6.040 1.00 89.48 130 A 1 ATOM 1048 C CD . ARG A 0 130 . -2.745 -3.523 7.244 1.00 89.48 130 A 1 ATOM 1049 N NE . ARG A 0 130 . -1.337 -3.314 7.630 1.00 89.48 130 A 1 ATOM 1050 N NH1 . ARG A 0 130 . -1.707 -1.631 9.147 1.00 89.48 130 A 1 ATOM 1051 N NH2 . ARG A 0 130 . 0.363 -2.326 8.774 1.00 89.48 130 A 1 ATOM 1052 C CZ . ARG A 0 130 . -0.907 -2.436 8.515 1.00 89.48 130 A 1 ATOM 1053 N N . VAL A 0 131 . -4.193 -6.420 3.520 1.00 86.78 131 A 1 ATOM 1054 C CA . VAL A 0 131 . -5.521 -7.028 3.351 1.00 86.78 131 A 1 ATOM 1055 C C . VAL A 0 131 . -6.016 -7.586 4.676 1.00 86.78 131 A 1 ATOM 1056 C CB . VAL A 0 131 . -5.528 -8.116 2.260 1.00 86.78 131 A 1 ATOM 1057 O O . VAL A 0 131 . -5.215 -7.906 5.571 1.00 86.78 131 A 1 ATOM 1058 C CG1 . VAL A 0 131 . -5.201 -7.491 0.902 1.00 86.78 131 A 1 ATOM 1059 C CG2 . VAL A 0 131 . -4.551 -9.266 2.541 1.00 86.78 131 A 1 ATOM 1060 N N . CYS A 0 132 . -7.331 -7.702 4.820 1.00 85.10 132 A 1 ATOM 1061 C CA . CYS A 0 132 . -7.903 -8.401 5.956 1.00 85.10 132 A 1 ATOM 1062 C C . CYS A 0 132 . -7.471 -9.869 5.976 1.00 85.10 132 A 1 ATOM 1063 C CB . CYS A 0 132 . -9.423 -8.234 5.935 1.00 85.10 132 A 1 ATOM 1064 O O . CYS A 0 132 . -7.466 -10.563 4.962 1.00 85.10 132 A 1 ATOM 1065 S SG . CYS A 0 132 . -9.931 -6.564 6.402 1.00 85.10 132 A 1 ATOM 1066 N N . CYS A 0 133 . -7.107 -10.368 7.156 1.00 81.48 133 A 1 ATOM 1067 C CA . CYS A 0 133 . -6.977 -11.801 7.316 1.00 81.48 133 A 1 ATOM 1068 C C . CYS A 0 133 . -8.359 -12.425 7.310 1.00 81.48 133 A 1 ATOM 1069 C CB . CYS A 0 133 . -6.357 -12.192 8.644 1.00 81.48 133 A 1 ATOM 1070 O O . CYS A 0 133 . -9.205 -12.076 8.140 1.00 81.48 133 A 1 ATOM 1071 S SG . CYS A 0 133 . -4.713 -11.612 9.010 1.00 81.48 133 A 1 ATOM 1072 N N . CYS A 0 134 . -8.509 -13.477 6.524 1.00 71.81 134 A 1 ATOM 1073 C CA . CYS A 0 134 . -9.531 -14.452 6.810 1.00 71.81 134 A 1 ATOM 1074 C C . CYS A 0 134 . -9.204 -15.174 8.112 1.00 71.81 134 A 1 ATOM 1075 C CB . CYS A 0 134 . -9.685 -15.372 5.598 1.00 71.81 134 A 1 ATOM 1076 O O . CYS A 0 134 . -8.231 -15.926 8.206 1.00 71.81 134 A 1 ATOM 1077 S SG . CYS A 0 134 . -10.832 -14.606 4.456 1.00 71.81 134 A 1 ATOM 1078 N N . LYS A 0 135 . -9.990 -14.927 9.165 1.00 49.44 135 A 1 ATOM 1079 C CA . LYS A 0 135 . -9.878 -15.721 10.385 1.00 49.44 135 A 1 ATOM 1080 C C . LYS A 0 135 . -10.318 -17.154 10.074 1.00 49.44 135 A 1 ATOM 1081 C CB . LYS A 0 135 . -10.730 -15.142 11.526 1.00 49.44 135 A 1 ATOM 1082 O O . LYS A 0 135 . -11.486 -17.484 10.209 1.00 49.44 135 A 1 ATOM 1083 C CG . LYS A 0 135 . -10.101 -13.966 12.286 1.00 49.44 135 A 1 ATOM 1084 C CD . LYS A 0 135 . -11.028 -13.654 13.468 1.00 49.44 135 A 1 ATOM 1085 C CE . LYS A 0 135 . -10.537 -12.491 14.328 1.00 49.44 135 A 1 ATOM 1086 N NZ . LYS A 0 135 . -11.521 -12.226 15.409 1.00 49.44 135 A 1 ATOM 1087 N N . PHE A 0 136 . -9.352 -18.040 9.850 1.00 39.87 136 A 1 ATOM 1088 C CA . PHE A 0 136 . -9.503 -19.453 10.225 1.00 39.87 136 A 1 ATOM 1089 C C . PHE A 0 136 . -9.457 -19.652 11.756 1.00 39.87 136 A 1 ATOM 1090 C CB . PHE A 0 136 . -8.460 -20.310 9.495 1.00 39.87 136 A 1 ATOM 1091 O O . PHE A 0 136 . -9.682 -20.752 12.262 1.00 39.87 136 A 1 ATOM 1092 C CG . PHE A 0 136 . -8.855 -20.638 8.070 1.00 39.87 136 A 1 ATOM 1093 C CD1 . PHE A 0 136 . -9.783 -21.670 7.826 1.00 39.87 136 A 1 ATOM 1094 C CD2 . PHE A 0 136 . -8.304 -19.923 6.989 1.00 39.87 136 A 1 ATOM 1095 C CE1 . PHE A 0 136 . -10.154 -21.990 6.508 1.00 39.87 136 A 1 ATOM 1096 C CE2 . PHE A 0 136 . -8.673 -20.248 5.671 1.00 39.87 136 A 1 ATOM 1097 C CZ . PHE A 0 136 . -9.596 -21.281 5.431 1.00 39.87 136 A 1 ATOM 1098 N N . LYS A 0 137 . -9.207 -18.588 12.538 1.00 32.52 137 A 1 ATOM 1099 C CA . LYS A 0 137 . -9.259 -18.610 14.008 1.00 32.52 137 A 1 ATOM 1100 C C . LYS A 0 137 . -10.704 -18.626 14.526 1.00 32.52 137 A 1 ATOM 1101 C CB . LYS A 0 137 . -8.430 -17.460 14.621 1.00 32.52 137 A 1 ATOM 1102 O O . LYS A 0 137 . -11.175 -17.622 15.050 1.00 32.52 137 A 1 ATOM 1103 C CG . LYS A 0 137 . -6.950 -17.825 14.792 1.00 32.52 137 A 1 ATOM 1104 C CD . LYS A 0 137 . -6.214 -16.752 15.611 1.00 32.52 137 A 1 ATOM 1105 C CE . LYS A 0 137 . -4.786 -17.221 15.913 1.00 32.52 137 A 1 ATOM 1106 N NZ . LYS A 0 137 . -4.041 -16.254 16.759 1.00 32.52 137 A 1 ATOM 1107 N N . SER A 0 138 . -11.362 -19.776 14.410 1.00 33.81 138 A 1 ATOM 1108 C CA . SER A 0 138 . -12.101 -20.397 15.525 1.00 33.81 138 A 1 ATOM 1109 C C . SER A 0 138 . -12.697 -21.759 15.177 1.00 33.81 138 A 1 ATOM 1110 C CB . SER A 0 138 . -13.237 -19.548 16.124 1.00 33.81 138 A 1 ATOM 1111 O O . SER A 0 138 . -13.174 -22.403 16.102 1.00 33.81 138 A 1 ATOM 1112 O OG . SER A 0 138 . -14.331 -19.492 15.241 1.00 33.81 138 A 1 ATOM 1113 N N . LEU A 0 139 . -12.636 -22.267 13.935 1.00 31.92 139 A 1 ATOM 1114 C CA . LEU A 0 139 . -13.145 -23.625 13.709 1.00 31.92 139 A 1 ATOM 1115 C C . LEU A 0 139 . -12.305 -24.638 14.499 1.00 31.92 139 A 1 ATOM 1116 C CB . LEU A 0 139 . -13.275 -23.987 12.217 1.00 31.92 139 A 1 ATOM 1117 O O . LEU A 0 139 . -12.862 -25.410 15.259 1.00 31.92 139 A 1 ATOM 1118 C CG . LEU A 0 139 . -14.622 -24.699 11.950 1.00 31.92 139 A 1 ATOM 1119 C CD1 . LEU A 0 139 . -15.722 -23.671 11.672 1.00 31.92 139 A 1 ATOM 1120 C CD2 . LEU A 0 139 . -14.531 -25.648 10.761 1.00 31.92 139 A 1 ATOM 1121 N N . PHE A 0 140 . -10.974 -24.547 14.468 1.00 32.18 140 A 1 ATOM 1122 C CA . PHE A 0 140 . -10.130 -25.479 15.226 1.00 32.18 140 A 1 ATOM 1123 C C . PHE A 0 140 . -10.038 -25.202 16.728 1.00 32.18 140 A 1 ATOM 1124 C CB . PHE A 0 140 . -8.740 -25.566 14.599 1.00 32.18 140 A 1 ATOM 1125 O O . PHE A 0 140 . -9.758 -26.131 17.464 1.00 32.18 140 A 1 ATOM 1126 C CG . PHE A 0 140 . -8.756 -26.350 13.308 1.00 32.18 140 A 1 ATOM 1127 C CD1 . PHE A 0 140 . -8.808 -27.756 13.348 1.00 32.18 140 A 1 ATOM 1128 C CD2 . PHE A 0 140 . -8.754 -25.681 12.070 1.00 32.18 140 A 1 ATOM 1129 C CE1 . PHE A 0 140 . -8.851 -28.493 12.153 1.00 32.18 140 A 1 ATOM 1130 C CE2 . PHE A 0 140 . -8.796 -26.420 10.875 1.00 32.18 140 A 1 ATOM 1131 C CZ . PHE A 0 140 . -8.843 -27.824 10.917 1.00 32.18 140 A 1 ATOM 1132 N N . VAL A 0 141 . -10.311 -23.989 17.219 1.00 34.70 141 A 1 ATOM 1133 C CA . VAL A 0 141 . -10.359 -23.761 18.680 1.00 34.70 141 A 1 ATOM 1134 C C . VAL A 0 141 . -11.738 -24.132 19.224 1.00 34.70 141 A 1 ATOM 1135 C CB . VAL A 0 141 . -9.916 -22.340 19.072 1.00 34.70 141 A 1 ATOM 1136 O O . VAL A 0 141 . -11.834 -24.832 20.220 1.00 34.70 141 A 1 ATOM 1137 C CG1 . VAL A 0 141 . -9.944 -22.127 20.589 1.00 34.70 141 A 1 ATOM 1138 C CG2 . VAL A 0 141 . -8.481 -22.069 18.592 1.00 34.70 141 A 1 ATOM 1139 N N . TYR A 0 142 . -12.821 -23.782 18.526 1.00 30.72 142 A 1 ATOM 1140 C CA . TYR A 0 142 . -14.177 -24.086 18.986 1.00 30.72 142 A 1 ATOM 1141 C C . TYR A 0 142 . -14.575 -25.551 18.742 1.00 30.72 142 A 1 ATOM 1142 C CB . TYR A 0 142 . -15.162 -23.097 18.349 1.00 30.72 142 A 1 ATOM 1143 O O . TYR A 0 142 . -15.245 -26.145 19.588 1.00 30.72 142 A 1 ATOM 1144 C CG . TYR A 0 142 . -16.392 -22.850 19.194 1.00 30.72 142 A 1 ATOM 1145 C CD1 . TYR A 0 142 . -17.577 -23.571 18.959 1.00 30.72 142 A 1 ATOM 1146 C CD2 . TYR A 0 142 . -16.338 -21.890 20.223 1.00 30.72 142 A 1 ATOM 1147 C CE1 . TYR A 0 142 . -18.713 -23.323 19.754 1.00 30.72 142 A 1 ATOM 1148 C CE2 . TYR A 0 142 . -17.470 -21.642 21.021 1.00 30.72 142 A 1 ATOM 1149 O OH . TYR A 0 142 . -19.758 -22.151 21.557 1.00 30.72 142 A 1 ATOM 1150 C CZ . TYR A 0 142 . -18.659 -22.364 20.788 1.00 30.72 142 A 1 ATOM 1151 N N . TYR A 0 143 . -14.143 -26.166 17.631 1.00 34.89 143 A 1 ATOM 1152 C CA . TYR A 0 143 . -14.266 -27.616 17.432 1.00 34.89 143 A 1 ATOM 1153 C C . TYR A 0 143 . -13.123 -28.404 18.060 1.00 34.89 143 A 1 ATOM 1154 C CB . TYR A 0 143 . -14.471 -28.041 15.969 1.00 34.89 143 A 1 ATOM 1155 O O . TYR A 0 143 . -13.394 -29.504 18.511 1.00 34.89 143 A 1 ATOM 1156 C CG . TYR A 0 143 . -15.913 -28.002 15.522 1.00 34.89 143 A 1 ATOM 1157 C CD1 . TYR A 0 143 . -16.649 -29.202 15.506 1.00 34.89 143 A 1 ATOM 1158 C CD2 . TYR A 0 143 . -16.517 -26.792 15.131 1.00 34.89 143 A 1 ATOM 1159 C CE1 . TYR A 0 143 . -17.989 -29.203 15.082 1.00 34.89 143 A 1 ATOM 1160 C CE2 . TYR A 0 143 . -17.866 -26.787 14.721 1.00 34.89 143 A 1 ATOM 1161 O OH . TYR A 0 143 . -19.894 -27.987 14.289 1.00 34.89 143 A 1 ATOM 1162 C CZ . TYR A 0 143 . -18.598 -27.993 14.690 1.00 34.89 143 A 1 ATOM 1163 N N . GLY A 0 144 . -11.902 -27.878 18.177 1.00 34.43 144 A 1 ATOM 1164 C CA . GLY A 0 144 . -10.837 -28.558 18.926 1.00 34.43 144 A 1 ATOM 1165 C C . GLY A 0 144 . -11.204 -28.719 20.396 1.00 34.43 144 A 1 ATOM 1166 O O . GLY A 0 144 . -11.145 -29.834 20.902 1.00 34.43 144 A 1 ATOM 1167 N N . ASP A 0 145 . -11.727 -27.669 21.041 1.00 35.07 145 A 1 ATOM 1168 C CA . ASP A 0 145 . -12.194 -27.760 22.430 1.00 35.07 145 A 1 ATOM 1169 C C . ASP A 0 145 . -13.450 -28.627 22.576 1.00 35.07 145 A 1 ATOM 1170 C CB . ASP A 0 145 . -12.466 -26.363 23.014 1.00 35.07 145 A 1 ATOM 1171 O O . ASP A 0 145 . -13.593 -29.342 23.568 1.00 35.07 145 A 1 ATOM 1172 C CG . ASP A 0 145 . -11.201 -25.607 23.434 1.00 35.07 145 A 1 ATOM 1173 O OD1 . ASP A 0 145 . -10.188 -26.280 23.721 1.00 35.07 145 A 1 ATOM 1174 O OD2 . ASP A 0 145 . -11.291 -24.362 23.529 1.00 35.07 145 A 1 ATOM 1175 N N . LYS A 0 146 . -14.369 -28.624 21.596 1.00 36.34 146 A 1 ATOM 1176 C CA . LYS A 0 146 . -15.538 -29.523 21.627 1.00 36.34 146 A 1 ATOM 1177 C C . LYS A 0 146 . -15.175 -30.977 21.356 1.00 36.34 146 A 1 ATOM 1178 C CB . LYS A 0 146 . -16.640 -29.067 20.661 1.00 36.34 146 A 1 ATOM 1179 O O . LYS A 0 146 . -15.783 -31.850 21.962 1.00 36.34 146 A 1 ATOM 1180 C CG . LYS A 0 146 . -17.727 -28.273 21.394 1.00 36.34 146 A 1 ATOM 1181 C CD . LYS A 0 146 . -18.841 -27.882 20.418 1.00 36.34 146 A 1 ATOM 1182 C CE . LYS A 0 146 . -19.968 -27.159 21.162 1.00 36.34 146 A 1 ATOM 1183 N NZ . LYS A 0 146 . -21.020 -26.701 20.220 1.00 36.34 146 A 1 ATOM 1184 N N . ILE A 0 147 . -14.227 -31.245 20.465 1.00 40.66 147 A 1 ATOM 1185 C CA . ILE A 0 147 . -13.772 -32.596 20.137 1.00 40.66 147 A 1 ATOM 1186 C C . ILE A 0 147 . -12.935 -33.141 21.299 1.00 40.66 147 A 1 ATOM 1187 C CB . ILE A 0 147 . -13.064 -32.607 18.760 1.00 40.66 147 A 1 ATOM 1188 O O . ILE A 0 147 . -13.220 -34.243 21.757 1.00 40.66 147 A 1 ATOM 1189 C CG1 . ILE A 0 147 . -14.105 -32.389 17.631 1.00 40.66 147 A 1 ATOM 1190 C CG2 . ILE A 0 147 . -12.344 -33.937 18.524 1.00 40.66 147 A 1 ATOM 1191 C CD1 . ILE A 0 147 . -13.490 -32.102 16.254 1.00 40.66 147 A 1 ATOM 1192 N N . LEU A 0 148 . -12.024 -32.351 21.880 1.00 38.82 148 A 1 ATOM 1193 C CA . LEU A 0 148 . -11.278 -32.737 23.085 1.00 38.82 148 A 1 ATOM 1194 C C . LEU A 0 148 . -12.200 -32.956 24.291 1.00 38.82 148 A 1 ATOM 1195 C CB . LEU A 0 148 . -10.194 -31.689 23.398 1.00 38.82 148 A 1 ATOM 1196 O O . LEU A 0 148 . -12.061 -33.966 24.978 1.00 38.82 148 A 1 ATOM 1197 C CG . LEU A 0 148 . -8.959 -31.784 22.481 1.00 38.82 148 A 1 ATOM 1198 C CD1 . LEU A 0 148 . -8.100 -30.530 22.627 1.00 38.82 148 A 1 ATOM 1199 C CD2 . LEU A 0 148 . -8.091 -32.996 22.832 1.00 38.82 148 A 1 ATOM 1200 N N . ARG A 0 149 . -13.211 -32.101 24.513 1.00 38.33 149 A 1 ATOM 1201 C CA . ARG A 0 149 . -14.224 -32.354 25.559 1.00 38.33 149 A 1 ATOM 1202 C C . ARG A 0 149 . -15.068 -33.595 25.290 1.00 38.33 149 A 1 ATOM 1203 C CB . ARG A 0 149 . -15.140 -31.139 25.760 1.00 38.33 149 A 1 ATOM 1204 O O . ARG A 0 149 . -15.500 -34.242 26.237 1.00 38.33 149 A 1 ATOM 1205 C CG . ARG A 0 149 . -14.536 -30.164 26.776 1.00 38.33 149 A 1 ATOM 1206 C CD . ARG A 0 149 . -15.463 -28.960 26.979 1.00 38.33 149 A 1 ATOM 1207 N NE . ARG A 0 149 . -15.352 -28.423 28.349 1.00 38.33 149 A 1 ATOM 1208 N NH1 . ARG A 0 149 . -16.433 -26.432 28.001 1.00 38.33 149 A 1 ATOM 1209 N NH2 . ARG A 0 149 . -15.755 -26.976 30.057 1.00 38.33 149 A 1 ATOM 1210 C CZ . ARG A 0 149 . -15.846 -27.285 28.795 1.00 38.33 149 A 1 ATOM 1211 N N . LYS A 0 150 . -15.313 -33.940 24.024 1.00 38.54 150 A 1 ATOM 1212 C CA . LYS A 0 150 . -16.073 -35.144 23.677 1.00 38.54 150 A 1 ATOM 1213 C C . LYS A 0 150 . -15.236 -36.411 23.855 1.00 38.54 150 A 1 ATOM 1214 C CB . LYS A 0 150 . -16.685 -34.997 22.278 1.00 38.54 150 A 1 ATOM 1215 O O . LYS A 0 150 . -15.789 -37.400 24.307 1.00 38.54 150 A 1 ATOM 1216 C CG . LYS A 0 150 . -17.991 -35.787 22.144 1.00 38.54 150 A 1 ATOM 1217 C CD . LYS A 0 150 . -18.673 -35.460 20.809 1.00 38.54 150 A 1 ATOM 1218 C CE . LYS A 0 150 . -20.034 -36.160 20.747 1.00 38.54 150 A 1 ATOM 1219 N NZ . LYS A 0 150 . -20.666 -36.019 19.412 1.00 38.54 150 A 1 ATOM 1220 N N . PHE A 0 151 . -13.928 -36.368 23.597 1.00 39.13 151 A 1 ATOM 1221 C CA . PHE A 0 151 . -13.023 -37.487 23.889 1.00 39.13 151 A 1 ATOM 1222 C C . PHE A 0 151 . -12.747 -37.652 25.389 1.00 39.13 151 A 1 ATOM 1223 C CB . PHE A 0 151 . -11.729 -37.342 23.077 1.00 39.13 151 A 1 ATOM 1224 O O . PHE A 0 151 . -12.735 -38.778 25.874 1.00 39.13 151 A 1 ATOM 1225 C CG . PHE A 0 151 . -11.885 -37.771 21.630 1.00 39.13 151 A 1 ATOM 1226 C CD1 . PHE A 0 151 . -12.077 -39.132 21.328 1.00 39.13 151 A 1 ATOM 1227 C CD2 . PHE A 0 151 . -11.813 -36.836 20.582 1.00 39.13 151 A 1 ATOM 1228 C CE1 . PHE A 0 151 . -12.225 -39.550 19.994 1.00 39.13 151 A 1 ATOM 1229 C CE2 . PHE A 0 151 . -11.956 -37.258 19.246 1.00 39.13 151 A 1 ATOM 1230 C CZ . PHE A 0 151 . -12.175 -38.612 18.953 1.00 39.13 151 A 1 ATOM 1231 N N . SER A 0 152 . -12.630 -36.559 26.151 1.00 41.68 152 A 1 ATOM 1232 C CA . SER A 0 152 . -12.451 -36.647 27.609 1.00 41.68 152 A 1 ATOM 1233 C C . SER A 0 152 . -13.661 -37.254 28.333 1.00 41.68 152 A 1 ATOM 1234 C CB . SER A 0 152 . -12.147 -35.269 28.195 1.00 41.68 152 A 1 ATOM 1235 O O . SER A 0 152 . -13.484 -37.835 29.395 1.00 41.68 152 A 1 ATOM 1236 O OG . SER A 0 152 . -11.661 -35.401 29.515 1.00 41.68 152 A 1 ATOM 1237 N N . ASN A 0 153 . -14.865 -37.154 27.759 1.00 42.07 153 A 1 ATOM 1238 C CA . ASN A 0 153 . -16.089 -37.760 28.303 1.00 42.07 153 A 1 ATOM 1239 C C . ASN A 0 153 . -16.356 -39.187 27.786 1.00 42.07 153 A 1 ATOM 1240 C CB . ASN A 0 153 . -17.281 -36.832 28.005 1.00 42.07 153 A 1 ATOM 1241 O O . ASN A 0 153 . -17.419 -39.731 28.061 1.00 42.07 153 A 1 ATOM 1242 C CG . ASN A 0 153 . -17.336 -35.581 28.858 1.00 42.07 153 A 1 ATOM 1243 N ND2 . ASN A 0 153 . -18.331 -34.753 28.635 1.00 42.07 153 A 1 ATOM 1244 O OD1 . ASN A 0 153 . -16.546 -35.310 29.741 1.00 42.07 153 A 1 ATOM 1245 N N . ILE A 0 154 . -15.452 -39.759 26.983 1.00 47.41 154 A 1 ATOM 1246 C CA . ILE A 0 154 . -15.518 -41.164 26.541 1.00 47.41 154 A 1 ATOM 1247 C C . ILE A 0 154 . -14.490 -42.024 27.301 1.00 47.41 154 A 1 ATOM 1248 C CB . ILE A 0 154 . -15.376 -41.235 24.996 1.00 47.41 154 A 1 ATOM 1249 O O . ILE A 0 154 . -14.633 -43.239 27.349 1.00 47.41 154 A 1 ATOM 1250 C CG1 . ILE A 0 154 . -16.597 -40.579 24.306 1.00 47.41 154 A 1 ATOM 1251 C CG2 . ILE A 0 154 . -15.238 -42.680 24.478 1.00 47.41 154 A 1 ATOM 1252 C CD1 . ILE A 0 154 . -16.393 -40.287 22.811 1.00 47.41 154 A 1 ATOM 1253 N N . ILE A 0 155 . -13.459 -41.405 27.894 1.00 46.58 155 A 1 ATOM 1254 C CA . ILE A 0 155 . -12.387 -42.100 28.631 1.00 46.58 155 A 1 ATOM 1255 C C . ILE A 0 155 . -12.671 -42.183 30.150 1.00 46.58 155 A 1 ATOM 1256 C CB . ILE A 0 155 . -11.010 -41.479 28.262 1.00 46.58 155 A 1 ATOM 1257 O O . ILE A 0 155 . -12.021 -42.964 30.838 1.00 46.58 155 A 1 ATOM 1258 C CG1 . ILE A 0 155 . -10.754 -41.611 26.737 1.00 46.58 155 A 1 ATOM 1259 C CG2 . ILE A 0 155 . -9.842 -42.134 29.027 1.00 46.58 155 A 1 ATOM 1260 C CD1 . ILE A 0 155 . -9.514 -40.866 26.222 1.00 46.58 155 A 1 ATOM 1261 N N . ASN A 0 156 . -13.669 -41.452 30.660 1.00 40.00 156 A 1 ATOM 1262 C CA . ASN A 0 156 . -14.206 -41.593 32.023 1.00 40.00 156 A 1 ATOM 1263 C C . ASN A 0 156 . -15.642 -42.108 31.969 1.00 40.00 156 A 1 ATOM 1264 C CB . ASN A 0 156 . -14.160 -40.236 32.751 1.00 40.00 156 A 1 ATOM 1265 O O . ASN A 0 156 . -16.035 -42.825 32.914 1.00 40.00 156 A 1 ATOM 1266 C CG . ASN A 0 156 . -12.786 -39.760 33.176 1.00 40.00 156 A 1 ATOM 1267 N ND2 . ASN A 0 156 . -12.652 -38.474 33.409 1.00 40.00 156 A 1 ATOM 1268 O OD1 . ASN A 0 156 . -11.823 -40.481 33.353 1.00 40.00 156 A 1 ATOM 1269 O OXT . ASN A 0 156 . -16.331 -41.683 31.014 1.00 40.00 156 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 73.98 # loop_ _atom_type.symbol C N O S #